COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK136962
Chemical Name: N-[3-({[(2E)-3-(2,4-dichlorophenyl)prop-2-enoyl]carbamothioyl}amino)phenyl]butanamide
Smiles: CCCC(=O)Nc1cccc(c1)NC(=S)NC(=O)/C=C/c1ccc(cc1Cl)Cl

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Molecular Weight: 436.36
Empirical Formula: C20H19Cl2N3O2S

Physical State: Dry powder
Available Amount: 598 mg

Lipinsky:
logP: 5.187
Rotatable bonds: 4
H-donors: 3
H-acceptors: 2
PSA: 102
Number of rings: 2

     

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