COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672136
Chemical Name: 1,3-bis(3,3-dinitrobutyl)urea
Smiles: O=C(NCCC([N+](=O)[O-])([N+](=O)[O-])C)NCCC([N+](=O)[O-])([N+](=O)[O-])C

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Molecular Weight: 352.26
Empirical Formula: C9H16N6O9

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 2.917
Rotatable bonds: 6
H-donors: 2
H-acceptors: 9
PSA: 224
Number of rings: 0

     

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