ATB | Existing Molecules

Selected Molecules (201-300 of 426)

Molid	Formula	Iupac	Common Name	Chembl Id	Clinical Phase	Atoms	Charge	Curation	Visibility
912765	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
912763	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
912760	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
912758	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
912756	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
912754	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
912752	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
912751	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
911976	C₈H₁₀N₄O₂	-	Caffeine	113	4	24	0	ATB	Public
911926	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
911141	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911139	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911138	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911136	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911134	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911133	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911131	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911130	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911129	C₄H₈O	BUTANAL	Butyraldehyde	1478334	4	13	0	ATB	Public
911127	C₈H₁₀O	2-PHENYLETHANOL	Phenylethylalcohol	448500	4	19	0	ATB	Public
911122	C₈H₁₀O	2-PHENYLETHANOL	Phenylethylalcohol	448500	4	19	0	ATB	Public
911118	C₈H₁₀O	2-PHENYLETHANOL	Phenylethylalcohol	448500	4	19	0	ATB	Public
911115	C₈H₁₀O	2-PHENYLETHANOL	Phenylethylalcohol	448500	4	19	0	ATB	Public
911110	C₈H₁₀O	2-PHENYLETHANOL	Phenylethylalcohol	448500	4	19	0	ATB	Public
911104	C₈H₁₀O	2-PHENYLETHANOL	Phenylethylalcohol	448500	4	19	0	ATB	Public
902518	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
902508	C₇H₁₄O	Heptanal	Heptanal	18104	4	22	0	ATB	Public
902416	C₅H₁₂O	(2R)-pentan-2-ol	(2R)-2-Pentanol		3	18	0	ATB	Public
902413	C₅H₁₂O	Pentan-1-ol	pentanol	14568	3	18	0	ATB	Public
902410	C₅H₁₀O	Pentanal	Valeraldehyde	18602	4	16	0	ATB	Public
902401	C₃H₆O	propanal	Propionaldehyde	275626	4	10	0	ATB	Public
902386	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
902361	C₆H₁₄O₂	1,1-Diethoxyethane	1,1-Diethoxyethane	1338583	4	22	0	ATB	Public
902317	C₁₇H₂₁NO	2-[di(phenyl)methoxy]-N,N-dimethylethanamine ...	Diphenhydramine	657	4	40	0	ATB	Public
902310	C₁₀H₂₀O	(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol ...	L-(-)-Menthol	470670	4	31	0	ATB	Public
902286	C₃H₆O	propanal	Propionaldehyde	275626	4	10	0	ATB	Public
902260	C₄H₁₀O	Ethoxyethane	Diethylether	16264	3	15	0	ATB	Public
850461	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
850426	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
845194	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
836840	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
836598	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
833207	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
832880	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
832849	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
831868	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
788945	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
766450	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
766442	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
766437	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
766427	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
765722	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
765711	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
765704	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
765699	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
765698	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
764070	C₁₀H₂₂	Decane	Decane	134537	3	32	0	ATB	Public
735802	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
734232	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
734231	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
734228	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
734227	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
734226	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
734225	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
733110	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
732734	C₈H₈O	1-Phenylethanone	Acetophenone	274467	3	17	0	ATB	Public
732642	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
732606	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
731470	C₈H₁₀N₄O₂	-	Caffeine	113	4	24	0	ATB	Public
726276	C₇H₅O₂	benzoic acid	phenylmethanedione	541	4	14	-1	ATB	Public
723474	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
723308	C₇H₅O₂	benzoic acid	phenylmethanedione	541	4	14	-1	ATB	Public
723053	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
721590	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
721307	C₆H₁₁O₂	Hexanoic acid	1-λ¹-oxidanylhexan-1-one ...	14184	4	19	-1	ATB	Public
720889	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
720287	C₁₀H₂₀O	(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol ...	L-(-)-Menthol	470670	4	31	0	ATB	Public
718629	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
716360	C₂H₆OS	Methylsulfinylmethane ...	Dimethylsulfoxide	504	1	10	0	ATB	Public
715298	C₁₀H₂₂	Decane	Decane	134537	3	32	0	ATB	Public
715065	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
715064	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
715063	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
715060	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
715059	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
705329	C₁₀H₂₀O	(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol ...	L-(-)-Menthol	470670	4	31	0	ATB	Public
701731	C₂H₆OS	Methylsulfinylmethane ...	Dimethylsulfoxide	504	1	10	0	ATB	Public
679733	C₈H₉NO₂	N-(4-Hydroxyphenyl)acetamide ...	Paracetamol	112	4	20	0	ATB	Public
642144	C₁₀H₁₉O₆PS₂	-	Diethyl(2S)-2-[(dimethoxyphosphorothioyl)sulfanyl]succinate ...		3	38	0	ATB	Public
611019	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
580577	C₆H₆O₂	Benzene-1,4-diol	Hydroquinone	537	4	14	0	ATB	Public
577276	C₁₀H₁₉O₆PS₂	-	Diethyl(2R)-2-[(dimethoxyphosphorothioyl)sulfanyl]succinate ...	1200468	3	38	0	ATB	Public
577275	C₁₀H₁₉O₆PS₂	-	Diethyl(2S)-2-[(dimethoxyphosphorothioyl)sulfanyl]succinate ...		3	38	0	ATB	Public
576001	C₈H₇O₂	2-phenylacetate	Phenylacetate	1044	2	17	-1	ATB	Public
574630	C₂H₃O₃	2-hydroxyacetate	2-hydroxy-1-λ¹-oxidanyl-ethanone ...	252557	4	8	-1	ATB	Public
574566	C₄H₁₁N₂	-	-		4	17	1	ATB	Public
574438	C₆H₆O	PHENOL	Phenol	14060	1	13	0	ATB	Public
574345	C₁₀H₂₂	Decane	Decane	134537	3	32	0	ATB	Public
573854	C₇H₈O	phenylmethanol	Benzylalcohol	720	3	16	0	ATB	Public
573796	C₁₇H₂₁NO	2-[di(phenyl)methoxy]-N,N-dimethylethanamine ...	Diphenhydramine	657	4	40	0	ATB	Public