COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK512600
Chemical Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(pyrimidin-2-ylsulfanyl)propan-1-amine
Smiles: C(NCc1ccc2c(c1)OCO2)CCSc1ncccn1

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Saltdata: HCl
Molecular Weight: 303.39
Empirical Formula: C15H17N3O2S

Physical State: Dry powder
Available Amount: 193 mg

Lipinsky:
logP: 2.699
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 81
Number of rings: 3

     

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