COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK626124
Chemical Name: 3-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CCSc1nc(Cl)nc2c1[nH]cn2

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Molecular Weight: 391.84
Empirical Formula: C16H14ClN5O3S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.73
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 127
Number of rings: 4

     

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