COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK587490
Chemical Name: 6-benzyl-1,3-dimethyl-5-(3-nitrophenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: [O-][N+](=O)c1cccc(c1)c1n(Cc2ccccc2)cc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 390.4
Empirical Formula: C21H18N4O4

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 3.348
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 4

     

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