COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK474114
Chemical Name: methyl2-{[(2Z)-2-cyano-3-{4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl}prop-2-enoyl]amino}-5-(propan-2-yl)thiophene-3-carboxylate
Smiles: N#C/C(=C/c1ccc(c(c1)COc1ccc(cc1)[N+](=O)[O-])OC)/C(=O)Nc1sc(cc1C(=O)OC)C(C)C

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Molecular Weight: 535.58
Empirical Formula: C27H25N3O7S

Physical State: Dry powder
Available Amount: 223 mg

Lipinsky:
logP: 7.546
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 171
Number of rings: 3

     

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