COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL430982
Chemical Name: (4Z)-4-{4-[bis(2-chloroethyl)amino]benzylidene}-1-(3-chlorophenyl)pyrazolidine-3,5-dione
Smiles: ClCCN(c1ccc(cc1)/C=C\1/C(=O)NN(C1=O)c1cccc(c1)Cl)CCCl

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Molecular Weight: 438.74
Empirical Formula: C20H18Cl3N3O2

Physical State: Dry powder
Available Amount: 196 mg

Lipinsky:
logP: 4.847
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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