COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456330
Chemical Name: 1-{3-[(4-chloro-1H-pyrazol-1-yl)methyl]phenyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea
Smiles: COc1cc(CCNC(=S)Nc2cccc(c2)Cn2ncc(c2)Cl)ccc1OC

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Molecular Weight: 430.96
Empirical Formula: C21H23ClN4O2S

Physical State: Dry powder
Available Amount: 265 mg

Lipinsky:
logP: 3.326
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 92
Number of rings: 3

     

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