COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK864775
Chemical Name: methyl2-{[(2E)-2-cyano-3-(1H-indol-3-yl)prop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1c[nH]c2c1cccc2)/C(=O)Nc1sc(c(c1C(=O)OC)C)C

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Molecular Weight: 379.44
Empirical Formula: C20H17N3O3S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 5.639
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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