COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK654245
Chemical Name: 4-{4-[bis(2-chloroethyl)amino]phenyl}-2-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-5(3H)-one
Smiles: ClCCN(c1ccc(cc1)C1CC(=NC2=C1C(=O)CC(C2)(C)C)O)CCCl

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Molecular Weight: 409.36
Empirical Formula: C21H26Cl2N2O2

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 3.488
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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