COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK419837
Chemical Name: 4-chloro-N-[3-({[(4-chloro-2-nitrophenyl)carbonyl]amino}methyl)-3,5,5-trimethylcyclohexyl]-2-nitrobenzamide
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])C(=O)NCC1(C)CC(NC(=O)c2ccc(cc2[N+](=O)[O-])Cl)CC(C1)(C)C

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Molecular Weight: 537.4
Empirical Formula: C24H26Cl2N4O6

Physical State: Dry powder
Available Amount: 1312 mg

Lipinsky:
logP: 7.005
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 149
Number of rings: 3

     

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