COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK267473
Chemical Name: 1-(1,3-benzodioxol-5-yl)-N-[3-methoxy-4-(thiophen-2-ylmethoxy)benzyl]methanamine
Smiles: COc1cc(CNCc2ccc3c(c2)OCO3)ccc1OCc1cccs1

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Saltdata: HCl
Molecular Weight: 383.47
Empirical Formula: C21H21NO4S

Physical State: Dry powder
Available Amount: 445 mg

Lipinsky:
logP: 4.353
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 77
Number of rings: 4

     

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