COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK421184
Chemical Name: 3-methyl-4-nitro-N-[(1,3,3-trimethyl-5-{[(3-methyl-4-nitrophenyl)carbonyl]amino}cyclohexyl)methyl]benzamide
Smiles: O=C(c1ccc(c(c1)C)[N+](=O)[O-])NCC1(C)CC(NC(=O)c2ccc(c(c2)C)[N+](=O)[O-])CC(C1)(C)C

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Molecular Weight: 496.56
Empirical Formula: C26H32N4O6

Physical State: Dry powder
Available Amount: 2447 mg

Lipinsky:
logP: 5.97
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 149
Number of rings: 3

     

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