COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK323874
Chemical Name: (2E)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide
Smiles: CCCC(=O)N1CCN(CC1)c1ccc(cc1)NC(=O)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 456.93
Empirical Formula: C23H25ClN4O4

Physical State: Dry powder
Available Amount: 484 mg

Lipinsky:
logP: 3.723
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 3

     

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