nilvadipine   Click here for help

GtoPdb Ligand ID: 10160

Synonyms: Escor® | FR-34235 | FR34235
Compound class: Synthetic organic
Comment: Nilvadipine is a dihydropyridine class L-type calcium channel blocker that is used as an anti-hypertensive drug [1]. The INN indicates that nilvadipine is a mixture of enantiomers. We show the chemical structure without specified stereochemistry to represent the mixture.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 131.56
Molecular weight 385.13
XLogP 3.69
No. Lipinski's rules broken 0
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Canonical SMILES COC(=O)C1=C(C#N)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC(C)C)C
Isomeric SMILES COC(=O)C1=C(C#N)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC(C)C)C
InChI InChI=1S/C19H19N3O6/c1-10(2)28-19(24)15-11(3)21-14(9-20)17(18(23)27-4)16(15)12-6-5-7-13(8-12)22(25)26/h5-8,10,16,21H,1-4H3
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Summary of Clinical Use Click here for help
Nilvadipine is used to treat hypertension. It is not approved by the FDA or EMA, but individual national agencies have authorised clinical use (e.g. Germany, Japan, Austria, Finland and Portugal).