COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL090259
Chemical Name: 1-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-phenylthiourea
Smiles: Clc1ccc2c(c1)c(CCN/C(=N\C(=S)Nc1ccccc1)/Nc1nc(C)cc(n1)C)c[nH]2

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Molecular Weight: 478.02
Empirical Formula: C24H24ClN7S

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 5.161
Rotatable bonds: 3
H-donors: 4
H-acceptors: 0
PSA: 122
Number of rings: 4

     

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