COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL430451
Chemical Name: propan-2-yl2-(propan-2-yloxy)ethyl2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: CC(OCCOC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC(C)C)C)C

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Molecular Weight: 446.5
Empirical Formula: C23H30N2O7

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 4.733
Rotatable bonds: 10
H-donors: 1
H-acceptors: 7
PSA: 119
Number of rings: 2

     

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