diltiazem (cardizem) Report issue

Small molecule Approved FDA
AACT ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

414.518

ALogP

3.37

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COC1=CC=C(C=C1)[C@@H]2SC3=CC=CC=C3N(CCN(C)C)C(=O)[C@@H]2OC(C)=O
  • InChIKey: HSUGRBWQSSZJOP-RTWAWAEBSA-N
    1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1200805   ChEMBL
diltiazem malate

CHEMBL1697   ChEMBL
diltiazem hydrochloride

CHEMBL23   ChEMBL
diltiazem

EE92BBP03H   NCATS
diltiazem *

Diltiazem   Wikipedia

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