COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK401791
Chemical Name: (2E)-3-[4-(benzyloxy)phenyl]-N-(2-chloro-5-nitrophenyl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)OCc1ccccc1)/C(=O)Nc1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 433.85
Empirical Formula: C23H16ClN3O4

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 5.937
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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