COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL448017
Chemical Name: 1-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-(2-methoxyphenyl)urea
Smiles: COc1ccccc1NC(=O)/N=C(/Nc1nc(C)cc(n1)C)\NCCc1c[nH]c2c1cc(Cl)cc2

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Molecular Weight: 491.98
Empirical Formula: C25H26ClN7O2

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 4.456
Rotatable bonds: 4
H-donors: 4
H-acceptors: 2
PSA: 116
Number of rings: 4

     

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