COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380934
Chemical Name: (2E)-2-cyano-3-(2-hydroxy-6-nitronaphthalen-1-yl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-enamide
Smiles: N#C/C(=C\c1c(O)ccc2c1ccc(c2)[N+](=O)[O-])/C(=O)Nc1c(C)nn(c1C)C

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Molecular Weight: 391.39
Empirical Formula: C20H17N5O4

Physical State: Dry powder
Available Amount: 175 mg

Lipinsky:
logP: 3.671
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 136
Number of rings: 3

     

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