COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434572
Chemical Name: methyl2-{[(2E)-2-cyano-3-(1H-indol-3-yl)prop-2-enoyl]amino}-5-propylthiophene-3-carboxylate
Smiles: CCCc1cc(c(s1)NC(=O)/C(=C/c1c[nH]c2c1cccc2)/C#N)C(=O)OC

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Molecular Weight: 393.47
Empirical Formula: C21H19N3O3S

Physical State: Dry powder
Available Amount: 905 mg

Lipinsky:
logP: 6.242
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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