ATB | Existing Molecules

Selected Molecules (201-300 of 5,194)

Molid	Formula	Iupac	Common Name	Chembl Id	Clinical Phase	Atoms	Charge	Curation	Visibility
1268154	C₁₀H₁₄O₂	2-Methoxy-4-propylphenol ...	4-propylguaiacol	3186884		26	0	ATB	Public
1268060	C₁₀H₁₈O	(2E)-3,7-dimethyloct ...	Geraniol	25719		29	0	ATB	Public
1267812	C₆H₁₂O₂	Ethyl butanoate	ethylbutanoate	44800		20	0	ATB	Public
1267487	C₆H₇N	Aniline	phenylamine	538		14	0	ATB	Public
1266431	CH₅N	Methanamine	methylamine	43280		7	0	ATB	Public
1263491	H₄N	-	λ⁵-azane			5	1	ATB	Public
1263421	C₁₄H₁₁Cl₂NO₂	2-[2-[(2,6-dichlorophenyl)amino]phenyl]acetic acid ...	Diclofenac	139		30	0	ATB	Public
1263183	C₁₀H₁₉O₆PS₂	-	Diethyl(2S)-2-[(dimethoxyphosphorothioyl)sulfanyl]succinate ...		3	38	0	ATB	Public
1263066	C₆H₇N	Aniline	phenylamine	538		14	0	ATB	Public
1262396	C₁₀H₁₉O₆PS₂	-	Diethyl(2S)-2-[(dimethoxyphosphorothioyl)sulfanyl]succinate ...		3	38	0	ATB	Public
1262252	C₁₀H₁₉O₆PS₂	-	Diethyl(2S)-2-[(dimethoxyphosphorothioyl)sulfanyl]succinate ...		3	38	0	ATB	Public
1262047	C₁₆H₃₄	HEXADECANE	cetane	134994		50	0	ATB	Public
1260117	C₄H₈O	Oxolane	Tetrahydrofuran	276521		13	0	ATB	Public
1259251	C₁₂H₂₆	Dodecane	Dodecane	30959		38	0	ATB	Public
1258184	C₁₆H₁₀	PYRENE	Pyrene	279564		26	0	ATB	Public
1257857	C₁₆H₁₀	PYRENE	Pyrene	279564		26	0	ATB	Public
1255898	C₄H₈O₂	butanoic acid	Butanoicacid	14227		14	0	ATB	Public
1255572	C₆H₁₃NO	Hexanamide	n-Hexanamide	1523958		21	0	ATB	Public
1255532	C₆H₁₃NO	Hexanamide	n-Hexanamide	1523958		21	0	ATB	Public
1254925	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
1254509	C₅H₁₀O	Pentanal	Valeraldehyde	18602	4	16	0	ATB	Public
1254263	H₂O₂	hydrogen peroxide	Hydrogenperoxide	71595		4	0	ATB	Public
1253244	C₉H₁₁Cl₃NO₃PS	-	Chlorpyrifos	463210		29	0	ATB	Public
1250034	C₄H₉NO	N,N-Dimethylacetamide ...	N,N-Dimethylacetamide ...	11873		15	0	ATB	Public
1249994	C₅H₁₀O₂	3-Methylbutanoic acid ...	3-Methylbutanoicacid	568737		17	0	ATB	Public
1249993	C₅H₁₀O₂	3-Methylbutanoic acid ...	3-Methylbutanoicacid	568737		17	0	ATB	Public
1249992	C₅H₁₀O₂	3-Methylbutanoic acid ...	3-Methylbutanoicacid	568737		17	0	ATB	Public
1249991	C₅H₁₀O₂	3-Methylbutanoic acid ...	3-Methylbutanoicacid	568737		17	0	ATB	Public
1249990	C₅H₁₀O₂	3-Methylbutanoic acid ...	3-Methylbutanoicacid	568737		17	0	ATB	Public
1249988	C₅H₁₀O₂	3-Methylbutanoic acid ...	3-Methylbutanoicacid	568737		17	0	ATB	Public
1249738	C₈H₁₆	oct-1-ene	octene	1376677		24	0	ATB	Public
1249581	C₆₀	-	Buckminsterfullerene			60	0	ATB	Public
1249522	C₆H₆O	PHENOL	Phenol	14060	1	13	0	ATB	Public
1246800	C₃H₈O₃	PROPANE-1,2,3-TRIOL	glycerine	692	4	14	0	ATB	Public
1246753	C₄H₈O₂	butanoic acid	Butanoicacid	14227		14	0	ATB	Public
1246752	C₄H₈O₂	butanoic acid	Butanoicacid	14227		14	0	ATB	Public
1246748	C₄H₈O₂	butanoic acid	Butanoicacid	14227		14	0	ATB	Public
1246003	C₂H₆O₂	Ethane-1,2-diol	Ethyleneglycol	457299		10	0	ATB	Public
1242331	C₁₄H₁₅N₅O₆S	methyl 2-[(4-methoxy ...	-	1229749		41	0	ATB	Public
1239569	C₈H₈	Ethenylbenzene	phenylethene	285235		16	0	ATB	Public
1238239	C₂H₆O₂S	Methylsulfonylmethane ...	Methylsulfonylmethane ...	25028		11	0	ATB	Public
1237123	C₆H₁₃NO	Hexanamide	n-Hexanamide	1523958		21	0	ATB	Public
1236550	C₁₅H₁₆N₄O₅S	-	-	513261		41	0	ATB	Public
1234816	C₁₅H₃₂	Pentadecane	Pentadecane	1234557		47	0	ATB	Public
1234815	C₁₅H₃₂	Pentadecane	Pentadecane	1234557		47	0	ATB	Public
1234814	C₁₅H₃₂	Pentadecane	Pentadecane	1234557		47	0	ATB	Public
1232005	C₇H₁₄	Cycloheptane	Cycloheptane	453194		21	0	ATB	Public
1232003	C₆H₁₃NO	Hexanamide	n-Hexanamide	1523958		21	0	ATB	Public
1230771	C₇H₆O	BENZALDEHYDE	Benzaldehyde	15972	4	14	0	ATB	Public
1230692	C₂H₆O₂	Ethane-1,2-diol	Ethyleneglycol	457299		10	0	ATB	Public
1229036	C₆H₁₃NO	Hexanamide	n-Hexanamide	1523958		21	0	ATB	Public
1228110	CH₅N	Methanamine	methylamine	43280		7	0	ATB	Public
1227666	C₆H₁₃NO	Hexanamide	n-Hexanamide	1523958		21	0	ATB	Public
1225888	C₈H₉NO₂	N-(4-Hydroxyphenyl)acetamide ...	Paracetamol	112	4	20	0	ATB	Public
1225045	CH₄N₂O	UREA	Urea	985		8	0	ATB	Public
1225024	C₃H₇NO	N,N-Dimethylformamide ...	dimethylformamide	268291		12	0	ATB	Public
1224923	C₂H₆O₂	Ethane-1,2-diol	Ethyleneglycol	457299		10	0	ATB	Public
1224768	CH₄N₂O	UREA	Urea	985		8	0	ATB	Public
1224761	CH₄N₂O	UREA	Urea	985		8	0	ATB	Public
1224721	CH₄N₂O	UREA	Urea	985		8	0	ATB	Public
1224306	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1224294	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1224006	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1223335	C₂H₃Cl	Chloroethene	chloroethylene	2311071		6	0	ATB	Public
1218835	C₂H₃N	Acetonitrile	Acetonitrile	45211		6	0	ATB	Public
1218834	C₂H₃N	Acetonitrile	Acetonitrile	45211		6	0	ATB	Public
1216513	C₆₀	-	Buckminsterfullerene			60	0	ATB	Public
1214735	CH₄O	methanol	Methanol	14688		6	0	ATB	Public
1214107	C₆₀	-	Buckminsterfullerene			60	0	ATB	Public
1213703	H₂O	oxidane	Water	1098659		3	0	ATB	Public
1213564	C₆H₈N₂O₂	1,5-dimethylpyrimidine-2,4-dione ...	methylthymine			18	0	ATB	Public
1213485	C₆H₁₂O₆	(2R,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ...	.beta.-D-Glucopyranose ...	1614854	4	24	0	ATB	Public
1213192	C₇H₁₄N₂O₂S	-	aldicarb	3182309		26	0	ATB	Public
1212538	C₁₀H₁₂N₂O₅	2-[(2R)-butan-2-yl]-4,6-dinitrophenol ...	2-[(2R)-2-Butanyl]-4,6-dinitrophenol ...			29	0	ATB	Public
1212537	C₁₀H₁₂N₂O₅	2-[(2R)-butan-2-yl]-4,6-dinitrophenol ...	2-[(2R)-2-Butanyl]-4,6-dinitrophenol ...			29	0	ATB	Public
1212536	C₁₀H₁₂N₂O₅	2-[(2R)-butan-2-yl]-4,6-dinitrophenol ...	2-[(2R)-2-Butanyl]-4,6-dinitrophenol ...			29	0	ATB	Public
1212535	C₁₀H₁₂N₂O₅	2-[(2R)-butan-2-yl]-4,6-dinitrophenol ...	2-[(2R)-2-Butanyl]-4,6-dinitrophenol ...			29	0	ATB	Public
1212534	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1212533	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1212532	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1212531	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1212530	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1212529	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1212528	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1212527	C₆H₁₄O₆	(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol ...	D-(-)-Mannitol	689		26	0	ATB	Public
1212526	C₁₆H₁₄O₃	(2S)-2-[3-(benzoyl)phenyl]propanoic acid ...	Dexketoprofen	75435		33	0	ATB	Public
1212525	C₅H₁₀O₅	(2S,3R,4S,5R)-oxane-2,3,4,5-tetrol ...	alpha-D-Xylopyranose			20	0	ATB	Public
1212524	C₁₆H₁₃NO₃	1-(2-hydroxyethylamino)anthracene-9,10-dione ...	1-((2-Hydroxyethyl)amino)anthraquinone ...			33	0	ATB	Public
1212523	C₁₆H₁₃NO₃	1-(2-hydroxyethylamino)anthracene-9,10-dione ...	1-((2-Hydroxyethyl)amino)anthraquinone ...			33	0	ATB	Public
1212522	C₁₆H₁₃NO₃	1-(2-hydroxyethylamino)anthracene-9,10-dione ...	1-((2-Hydroxyethyl)amino)anthraquinone ...			33	0	ATB	Public
1212521	C₁₄H₁₄O₃	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid ...	Naproxen	154		31	0	ATB	Public
1212520	C₁₀H₂₀O	(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol ...	L-(-)-Menthol	470670	4	31	0	ATB	Public
1212519	C₁₄H₉NO₃	1-amino-4-hydroxyanthracene-9,10-dione ...	1-Amino-4-hydroxyanthraquinone ...	88326		27	0	ATB	Public
1212518	C₂₀H₂₃N	-	Amitriptyline	629		44	0	ATB	Public
1212517	C₂₀H₂₃N	-	Amitriptyline	629		44	0	ATB	Public
1212516	C₂₀H₂₃N	-	Amitriptyline	629		44	0	ATB	Public
1212515	C₂₀H₂₃N	-	Amitriptyline	629		44	0	ATB	Public
1212514	C₂₀H₂₃N	-	Amitriptyline	629		44	0	ATB	Public
1212513	C₂₀H₂₃N	-	Amitriptyline	629		44	0	ATB	Public
1212512	C₂₀H₂₃N	-	Amitriptyline	629		44	0	ATB	Public