Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0A2JV
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| Former ID |
DNC013224
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| Drug Name |
NSC-26699
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| Synonyms |
NSC26699; NSC-26699; CHEMBL221721; 7147-36-6; benzenesulfonic acid, 2-[(4-aminobenzoyl)amino]-5-(6-methyl-2-benzothiazolyl)-; 2-((4-aminobenzoyl)amino)-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid; 2-[(4-aminobenzoyl)amino]-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid; AC1Q6X1J; NCIStruc2_000974; NCIStruc1_001055; AC1L5L01; SCHEMBL14286195; CTK5D4244; DTXSID30282594; NCI26699; ZINC1634079; CCG-37345; NCGC00013335; BDBM50158385; AKOS030586545; NCGC00013335-02; NCGC00096452-01; NCI60_002153
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C21H17N3O4S2
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| Canonical SMILES |
CC1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)NC(=O)C4=CC=C(C=C4)N)S(=O)(=O)O
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| InChI |
1S/C21H17N3O4S2/c1-12-2-8-16-18(10-12)29-21(24-16)14-5-9-17(19(11-14)30(26,27)28)23-20(25)13-3-6-15(22)7-4-13/h2-11H,22H2,1H3,(H,23,25)(H,26,27,28)
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| InChIKey |
OINIYAOVPXPWNV-UHFFFAOYSA-N
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| CAS Number |
CAS 7147-36-6
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Phosphoribosylaminoimidazolecarboxamide formyltransferase (ATIC) | Target Info | Inhibitor | [1] |
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Virtual screening of human 5-aminoimidazole-4-carboxamide ribonucleotide transformylase against the NCI diversity set by use of AutoDock to identif... J Med Chem. 2004 Dec 30;47(27):6681-90. | |||
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