COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK623341
Chemical Name: 2-methoxyethyl(2E)-3-phenylprop-2-en-1-yl2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC/C=C/c1ccccc1)C

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Molecular Weight: 492.53
Empirical Formula: C27H28N2O7

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 5.356
Rotatable bonds: 10
H-donors: 1
H-acceptors: 7
PSA: 119
Number of rings: 3

     

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