labetalol (trandate) Report issue

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

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Chemistry

Mol. Mass

328.41

ALogP

2.14

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC(CCc1ccccc1)NCC(O)c2ccc(O)c(c2)C(=O)N
  • InChIKey: SGUAFYQXFOLMHL-UHFFFAOYSA-N
    InChI=1S/C19H24N2O3/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24/h2-6,9-11,13,18,21-23H,7-8,12H2,1H3,(H2,20,24)
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL429   ChEMBL
labetalol *

CHEMBL1200323   ChEMBL
labetalol hydrochloride

R5H8897N95   NCATS
labetalol *

Labetalol   Wikipedia

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