COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585318
Chemical Name: N-{(1Z)-1-[1-cyano-2-(cyclopentylamino)-2-oxoethylidene]-1H-isoindol-3-yl}-4-nitrobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)[N+](=O)[O-])/C(=O)NC1CCCC1

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Molecular Weight: 429.44
Empirical Formula: C23H19N5O4

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 2.243
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 4

     

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