COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK097851
Chemical Name: (2E)-3-[(4-chloro-3-nitrophenyl)amino]-1-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/Nc1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 362.77
Empirical Formula: C17H15ClN2O5

Physical State: Dry powder
Available Amount: 443 mg

Lipinsky:
logP: 4.32
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 2

     

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