COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161337
Chemical Name: methyl3-{(1E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxoprop-1-en-1-yl}-1H-indole-4-carboxylate
Smiles: COc1ccc(cc1)NC(=O)/C(=C/c1c[nH]c2c1c(ccc2)C(=O)OC)/C#N

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Molecular Weight: 375.38
Empirical Formula: C21H17N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.236
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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