COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK078704
Chemical Name: dimethyl4-(1,3-benzodioxol-5-yl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: COC(=O)C1=CN(Cc2cccs2)C=C(C1c1ccc2c(c1)OCO2)C(=O)OC

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Molecular Weight: 413.45
Empirical Formula: C21H19NO6S

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 2.52
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 102
Number of rings: 4

     

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