COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK076434
Chemical Name: 1-{(E)-[(4-chlorophenyl)amino][(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-prop-2-en-1-ylthiourea
Smiles: C=CCNC(=S)/N=C(/Nc1nc(C)cc(n1)C)\Nc1ccc(cc1)Cl

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Molecular Weight: 374.9
Empirical Formula: C17H19ClN6S

Physical State: Dry powder
Available Amount: 662 mg

Lipinsky:
logP: 4.078
Rotatable bonds: 2
H-donors: 3
H-acceptors: 0
PSA: 106
Number of rings: 2

     

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