COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK821543
Chemical Name: di-tert-butyl2,6-dimethyl-4-[5-(2-nitrophenyl)furan-2-yl]-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: CC1=C(C(=O)OC(C)(C)C)C(C(=C(N1)C)C(=O)OC(C)(C)C)c1ccc(o1)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 496.56
Empirical Formula: C27H32N2O7

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 6.189
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 123
Number of rings: 3

     

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