COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380687
Chemical Name: (2E)-3-[1-(4-chloro-3-nitrophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N-cycloheptylprop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(c(c1)[N+](=O)[O-])Cl)C)/C(=O)NC1CCCCCC1

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Molecular Weight: 440.93
Empirical Formula: C23H25ClN4O3

Physical State: Dry powder
Available Amount: 217 mg

Lipinsky:
logP: 5.624
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 3

     

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