COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL430975
Chemical Name: (4Z)-4-{4-[bis(2-chloroethyl)amino]benzylidene}-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione
Smiles: ClCCN(c1ccc(cc1)/C=C\1/C(=O)NN(C1=O)c1ccc(c(c1)C)C)CCCl

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Molecular Weight: 432.35
Empirical Formula: C22H23Cl2N3O2

Physical State: Dry powder
Available Amount: 283 mg

Lipinsky:
logP: 5.172
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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