COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK625077
Chemical Name: 3-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Smiles: COc1cc(CCNC(=O)CCSc2nc(Cl)nc3c2[nH]cn3)ccc1OC

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Molecular Weight: 421.91
Empirical Formula: C18H20ClN5O3S

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 2.492
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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