COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK405664
Chemical Name: dimethyl1-(1,3-benzodioxol-5-ylmethyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=CN(C=C1C(=O)OC)Cc1ccc2c(c1)OCO2)C(=O)OC

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Molecular Weight: 512.47
Empirical Formula: C25H24N2O10

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 2.872
Rotatable bonds: 9
H-donors: 1
H-acceptors: 10
PSA: 149
Number of rings: 4

     

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