ATB | Existing Molecules

Selected Molecules (1-100 of 253,433)

Molid	Formula	Iupac	Common Name	Chembl Id	Atoms	Charge	Date	Curation	Visibility
333033	C₂₁H₂₃N₂O₆	-	-		52	-1	2018-08-22	ATB	Public
333022	C₂₃H₃₂N₄O₇	-	-		66	0	2018-08-22	ATB	Public
333019	C₂₃H₃₂N₄O₇	-	-		66	0	2018-08-22	ATB	Public
333016	C₈Cl₂N₂O₂	4,5-Dichloro-3,6-dio ...	2,3-Dichloro-5,6-dicyano-1,4-benzoquinone ...		14	0	2018-08-22	ATB	Public
332985	C₁₃H₂₆O₂	Methyl dodecanoate	8IPS6BI6KW		41	0	2018-08-21	ATB	Public
332925	C₃₁H₆₀O₅	[(2R)-1-hydroxy-3-te ...	77SU067V2A		96	0	2018-08-21	ATB	Public
332920	C₁₂H₁₀S₂	4-(4-sulfanylphenyl)benzenethiol ...	DRF2J4LARU		24	0	2018-08-21	ATB	Public
332919	C₁₂H₁₀S₂	4-(4-sulfanylphenyl)benzenethiol ...	DRF2J4LARU		24	0	2018-08-21	ATB	Public
332918	C₁₂H₁₀S₂	4-(4-sulfanylphenyl)benzenethiol ...	DRF2J4LARU		24	0	2018-08-21	ATB	Public
332917	C₁₈H₂₁FN₂O₃S	-	N,N-Diethyl-4-{[(4-f ...		46	0	2018-08-21	ATB	Public
332914	C₁₀H₁₉NO₅	-	Methyl2-[(2S,6S)-2-( ...	1822737	35	0	2018-08-21	ATB	Public
332912	C₁₀H₂₁NO₃	-	[(2S,6S)-4-Butyl-6-methoxy-2-morpholinyl]methanol ...	1822733	35	0	2018-08-21	ATB	Public
332898	C₂₈H₅₆O₂	OCTACOSANOIC ACID	-		86	0	2018-08-20	ATB	Public
332892	C₁₄H₁₆N₂O₃	-	-	1822117	35	0	2018-08-22	ATB	Public
332889	C₁₄H₁₆N₂OS₂	-	-	1821908	35	0	2018-08-21	ATB	Public
332888	C₁₄H₁₆N₂O₂S	-	-	1821904	35	0	2018-08-21	ATB	Public
332887	C₁₅H₁₈N₂	-	-	1821807	35	0	2018-08-21	ATB	Public
332886	C₁₆H₁₄N₂O₃	-	-	1819312	35	0	2018-08-22	ATB	Public
332885	C₁₃H₁₃N₃S	(1-naphthalen-1-ylethylideneamino)thiourea ...	-		30	0	2018-08-21	ATB	Public
332884	C₉H₈F₃N₃S	[[4-(trifluoromethyl)phenyl]methylideneamino]thiourea ...	-		24	0	2018-08-21	ATB	Public
332883	C₈H₈N₄O₂S	[(2-nitrophenyl)methylideneamino]thiourea ...	(2E)-2-(2-Nitrobenzylidene)hydrazinecarbothioamide ...	3194855	23	0	2018-08-21	ATB	Public
332882	C₁₆H₁₄N₂O₃	-	-	1819310	35	0	2018-08-21	ATB	Public
332879	C₃₅H₅₅N₅O₁₂	-	-		107	0	2018-08-20	ATB	Public
332877	C₃₂H₄₉N₅O₁₂	-	-		98	0	2018-08-20	ATB	Public
332876	C₃₄H₅₃N₅O₁₂	-	-		104	0	2018-08-20	ATB	Public
332875	C₃₃H₅₁N₅O₁₂	-	-		101	0	2018-08-20	ATB	Public
332873	C₁₄H₁₂Cl₄N₂O₃	-	-	1819035	35	0	2018-08-22	ATB	Public
332871	C₁₄H₁₄Cl₂N₂O₃	-	-	1819029	35	0	2018-08-21	ATB	Public
332870	C₁₄H₁₈O₃	-	-	1818702	35	0	2018-08-21	ATB	Public
332869	C₁₄H₁₈O₃	-	-	1818698	35	0	2018-08-21	ATB	Public
332867	C₁₀H₁₈N₂O₄S	-	-	1818673	35	0	2018-08-21	ATB	Public
332865	C₉H₁₈N₂O₅S	-	-	1818669	35	0	2018-08-21	ATB	Public
332863	C₁₇H₁₅N₃	-	-	1818581	35	0	2018-08-21	ATB	Public
332861	C₁₅H₁₅N₅	-	-	1818577	35	0	2018-08-21	ATB	Public
332860	C₁₁H₂₁NOS	-	-	1818510	35	0	2018-08-21	ATB	Public
332858	C₈H₁₆O₉P₂	-	-	1818158	35	0	2018-08-22	ATB	Public
332856	C₈H₁₆O₉P₂	-	-	1818157	35	0	2018-08-21	ATB	Public
332855	C₁₆H₁₄N₄O	-	-	1818119	35	0	2018-08-21	ATB	Public
332854	C₁₅H₁₅N₅	-	-	1818110	35	0	2018-08-21	ATB	Public
332853	C₁₆H₁₆O₃	-	-	1817805	35	0	2018-08-21	ATB	Public
332848	C₁₆H₁₆O₃	-	-	1817801	35	0	2018-08-21	ATB	Public
332847	C₁₆H₁₆O₃	-	-	1817799	35	0	2018-08-21	ATB	Public
332846	C₁₆H₁₅FO₃	-	-	1817796	35	0	2018-08-21	ATB	Public
332845	C₁₆H₁₆O₃	-	-	1817795	35	0	2018-08-21	ATB	Public
332844	C₁₆H₁₆O₃	4-[2-(2,5-dimethoxyp ...	-	1817793	35	0	2018-08-21	ATB	Public
332843	C₁₆H₁₅FO₃	-	-	1817790	35	0	2018-08-21	ATB	Public
332841	C₁₃H₁₄N₄O₄	-	-	1814776	35	0	2018-08-22	ATB	Public
332840	C₂₀H₁₃NO	-	-	1814605	35	0	2018-08-21	ATB	Public
332839	C₁₅H₁₂N₂O₆	methyl 4-[(2-nitrophenyl)carbamoyloxy]benzoate ...	-	1814528	35	0	2018-08-21	ATB	Public
332838	C₄₀H₉₆N₁₄	N,N,N',N'-tetrakis[3 ...	-		150	0	2018-08-20	ATB	Public
332837	C₁₅H₁₃ClN₂O₄	(2-carbamoylphenyl) N-(2-chloro-4-methoxyphenyl)carbamate ...	-	1814525	35	0	2018-08-22	ATB	Public
332836	C₁₅H₁₃ClN₂O₄	2-(4-chlorophenoxy)-N-(4-methyl-2-nitrophenyl)acetamide ...	-	1814520	35	0	2018-08-21	ATB	Public
332835	C₁₇H₁₁ClN₂O₄	N-(4-chloro-2-nitrop ...	-	1814518	35	0	2018-08-21	ATB	Public
332833	C₁₇H₁₄O₄	methyl 4-(3-oxo-3-phenylpropanoyl)benzoate ...	-	1814499	35	0	2018-08-21	ATB	Public
332831	C₁₃H₁₆N₄O₂	-	-	1814247	35	0	2018-08-21	ATB	Public
332829	C₁₃H₁₆N₄O₂	-	-	1814246	35	0	2018-08-21	ATB	Public
332827	C₁₇H₁₀ClF₃N₄	-	-	1814202	35	0	2018-08-22	ATB	Public
332817	C₁₇H₁₁Cl₂FN₄	-	-	1814193	35	0	2018-08-22	ATB	Public
332813	C₁₇H₁₁Cl₂FN₄	-	-	1814191	35	0	2018-08-22	ATB	Public
332811	C₁₇H₁₁ClF₂N₄	-	-	1814190	35	0	2018-08-21	ATB	Public
332807	C₁₇H₁₁Cl₂FN₄	-	-	1814187	35	0	2018-08-22	ATB	Public
332805	C₁₂H₁₅N₂O₅P	-	(2-{[(2-Methyl-1,3-d ...	1814095	35	0	2018-08-21	ATB	Public
332804	C₁₇H₁₃N₃O₂	-	-	1814093	35	0	2018-08-21	ATB	Public
332802	C₁₇H₁₁NO₆	-	-	1814076	35	0	2018-08-21	ATB	Public
332798	C₁₅H₁₁ClN₂O₅S	-	-	1813973	35	0	2018-08-21	ATB	Public
332797	C₁₅H₁₁FN₂O₅S	-	(2E)-N-[(4-Fluorophe ...	1813972	35	0	2018-08-22	ATB	Public
332796	C₁₅H₁₂N₂O₅S	-	(2E)-3-(2-Nitrophenyl)-N-(phenylsulfonyl)acrylamide ...	1813970	35	0	2018-08-21	ATB	Public
332795	C₁₅H₁₁BrN₂O₅S	-	(2E)-N-[(4-Bromophen ...	1813969	35	0	2018-08-21	ATB	Public
332792	C₁₅H₁₂N₂O₅S	-	(2E)-3-(4-Nitrophenyl)-N-(phenylsulfonyl)acrylamide ...	1813965	35	0	2018-08-21	ATB	Public
332791	C₁₆H₁₁N₃O₅	-	2-(2,3-Dihydro-1,4-b ...	1813923	35	0	2018-08-21	ATB	Public
332790	C₁₂H₁₇N₅O	-	(3S)-1-(3-Amino-1,6- ...	1813784	35	0	2018-08-20	ATB	Public
332789	C₁₂H₁₇N₅O	-	-	1813782	35	0	2018-08-20	ATB	Public
332788	C₁₅H₁₄N₄O₂	-	N-(1-Methyl-4-oxo-6- ...	1813777	35	0	2018-08-20	ATB	Public
332785	C₁₂H₁₆N₄O₃	-	Methyl3-(3-amino-1,6 ...	1813627	35	0	2018-08-20	ATB	Public
332783	C₁₂H₁₇N₅O	-	3-Amino-1-methyl-6-( ...	1813626	35	0	2018-08-20	ATB	Public
332781	C₁₂H₁₇N₅O	-	3-Amino-6-(4-piperid ...	1813615	35	0	2018-08-20	ATB	Public
332780	C₁₆H₁₄N₂O₃	-	2,3-Dihydroxy-N-(1H-indol-5-ylmethyl)benzamide ...	1813493	35	0	2018-08-21	ATB	Public
332779	C₂₀H₃₈O₁₁	(2R,3R,4S,5R,6S)-3,4 ...	Methyl2,3,6-tri-O-me ...		69	0	2018-08-19	ATB	Public
332778	C₃₆H₇₀O₁₉	-	-		125	0	2018-08-19	ATB	Public
332776	C₂₂H₃₀N₄O₇	-	-		63	0	2018-08-19	ATB	Public
332775	C₁₅H₁₂N₄O₄	-	-	1813391	35	0	2018-08-21	ATB	Public
332774	C₁₈H₁₄O₃	1,6-dimethyl-8,9-dih ...	1,6-Dimethyl-8,9-dihydrophenanthro[1,2-b]furan-10,11-dione ...	1813349	35	0	2018-08-21	ATB	Public
332772	C₁₆H₁₃NO₅	-	(2E)-2-(2-Methoxyphenyl)-3-(4-nitrophenyl)acrylicacid ...	1813305	35	0	2018-08-21	ATB	Public
332771	C₁₇H₁₂O₆	(3Z)-5-(3,4-dihydrox ...	(Z)-3-(3,4-dihydroxy ...	1813265	35	0	2018-08-22	ATB	Public
332769	C₁₃H₁₈O₄	-	-	1813186	35	0	2018-08-20	ATB	Public
332768	C₁₅H₁₄N₄OS	-	1-Methyl-N-[(2Z)-4-m ...	1812778	35	0	2018-08-20	ATB	Public
332767	C₁₅H₁₃ClN₄OS	-	N-[(2Z)-3-(4-Chlorop ...	1812777	35	0	2018-08-21	ATB	Public
332766	C₁₇H₁₄ClNO₂	6-chloro-3-(hydroxym ...	6-Chloro-3-(hydroxym ...	1812727	35	0	2018-08-21	ATB	Public
332764	C₁₇H₁₄N₂O₂	-	-	1812525	35	0	2018-08-21	ATB	Public
332763	C₄₁H₉₈N₁₄	-	-		153	0	2018-08-19	ATB	Public
332761	C₁₇H₁₄N₂O₂	-	-	1812518	35	0	2018-08-20	ATB	Public
332759	C₁₇H₁₄N₂O₂	-	-	1812511	35	0	2018-08-20	ATB	Public
332756	C₂₂H₃₀N₄O₇	-	-		63	0	2018-08-19	ATB	Public
332755	C₁₆H₁₃BrClN₃O	-	-	1812487	35	0	2018-08-21	ATB	Public
332754	C₂₂H₃₀N₄O₇	-	-		63	0	2018-08-19	ATB	Public
332753	C₁₆H₁₄ClN₃O	-	2-Chloro-N-[2-(4-met ...	1812374	35	0	2018-08-20	ATB	Public
332752	C₁₇H₁₅ClN₂	-	7-Chloro-N-[(1R)-1-phenylethyl]-4-quinolinamine ...	1812337	35	0	2018-08-20	ATB	Public
332749	C₁₃H₁₄F₃NO₃S	-	EthylN-({4-[(trifluo ...	1812117	35	0	2018-08-20	ATB	Public
332748	C₁₆H₁₂O₇	-	R78YLI0R53	1812029	35	0	2018-08-21	ATB	Public
332747	C₁₆H₁₄O₅	-	(2S)-7-Hydroxy-2-(4- ...	1811969	35	0	2018-08-20	ATB	Public

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Automated Topology Builder (ATB) and Repository
Version 2.2

Existing Molecules

Selected Molecules (1-100 of 253,433)

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Automated Topology Builder (ATB) and Repository Version 2.2

Existing Molecules

Selected Molecules (1-100 of 253,433)

Can't find your molecule ?

Contact

Contributors

Automated Topology Builder (ATB) and Repository
Version 2.2