COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK532284
Chemical Name: 2,2'-({4-[bis(2-chloroethyl)amino]phenyl}methanediyl)bis(5-phenylcyclohexane-1,3-dione)
Smiles: ClCCN(c1ccc(cc1)C(C1C(=O)CC(CC1=O)c1ccccc1)C1C(=O)CC(CC1=O)c1ccccc1)CCCl

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Molecular Weight: 604.57
Empirical Formula: C35H35Cl2NO4

Physical State: Dry powder
Available Amount: 274 mg

Lipinsky:
logP: 5.347
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 71
Number of rings: 5

     

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