COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK624460
Chemical Name: 5-(4-chloro-3-nitrophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: O=C1N(c2ccc(c(c2)[N+](=O)[O-])Cl)C(=O)C2C1ON=C2c1c(C)nn(c1C)C

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Molecular Weight: 403.78
Empirical Formula: C17H14ClN5O5

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 1.397
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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