COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564630
Chemical Name: 6-hydroxy-3-methyl-7-(naphthalen-1-ylmethyl)-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: O=c1nc(O)c2c(n1C)nc(n2Cc1cccc2c1cccc2)N/N=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 469.46
Empirical Formula: C24H19N7O4

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 4.076
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 5

     

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