COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL331369
Chemical Name: dimethyl2-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])sc2c1C(CC2)C(=O)OC

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Molecular Weight: 430.44
Empirical Formula: C20H18N2O7S

Physical State: Dry powder
Available Amount: 158 mg

Lipinsky:
logP: 5.106
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 155
Number of rings: 3

     

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