COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK406034
Chemical Name: dimethyl1-(3-chloro-4-fluorophenyl)-4-(4-hydroxy-3-methoxy-5-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: COC(=O)C1=CN(C=C(C1c1cc(OC)c(c(c1)[N+](=O)[O-])O)C(=O)OC)c1ccc(c(c1)Cl)F

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Molecular Weight: 492.84
Empirical Formula: C22H18ClFN2O8

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 2.757
Rotatable bonds: 7
H-donors: 1
H-acceptors: 8
PSA: 131
Number of rings: 3

     

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