COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333421
Chemical Name: propan-2-yl4-cyano-3-methyl-5-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}thiophene-2-carboxylate
Smiles: N#Cc1c(NC(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)OC(C)C

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Molecular Weight: 399.43
Empirical Formula: C19H17N3O5S

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 5.21
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 153
Number of rings: 2

     

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