Details of the Drug

General Information of Drug (ID: DMT4NWX)

Drug Name

TELUDIPINE HYDROCHLORIDE

Synonyms

Former USAN >; GR-53992B; GX-1296B; Taludipine hydrochloride < former INNM; Teludipine hydrochloride< Rec INNM; Rac-4-[o-[(E)-2-Carboxyvinyl]phenyl]-2-[(dimethylamino)methyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid 4-tert-butyl diethyl ester monohydrochloride; Rac-2-(Dimethylaminomethyl)-4-[2-[3-(1,1-dimethylethoxy)-3-oxo-1(E)-propenyl]phenyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester monohydrochloride

Indication

Disease Entry	ICD 11	Status	REF
Hypertension	BA00-BA04	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski):
2

Molecular Weight

535.1

Logarithm of the Partition Coefficient

Not Available

Rotatable Bond Count

13

Hydrogen Bond Donor Count

2

Hydrogen Bond Acceptor Count

8

Chemical Identifiers

Formula: C28H39ClN2O6
IUPAC Name: diethyl 2-[(dimethylamino)methyl]-6-methyl-4-[2-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylate;hydrochloride
Canonical SMILES: CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2/C=C/C(=O)OC(C)(C)C)C(=O)OCC)CN(C)C)C.Cl
InChI: InChI=1S/C28H38N2O6.ClH/c1-9-34-26(32)23-18(3)29-21(17-30(7)8)25(27(33)35-10-2)24(23)20-14-12-11-13-19(20)15-16-22(31)36-28(4,5)6;/h11-16,24,29H,9-10,17H2,1-8H3;1H/b16-15+;
InChIKey: VMZCXIGDNRMWGI-GEEYTBSJSA-N

Cross-matching ID

PubChem CID: 9893335
CAS Number: 108700-03-4
TTD ID: D0LN9P

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Calcium channel unspecific (CaC)	TT5HONZ	NOUNIPROTAC	Blocker	[1]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Effects of R-enantiomer (GR66234A) and L-enantiomer (GR66235A) of telupidine, a new dihydropyridine derivative, on cell lines displaying the multidrug resistant phenotype. Haematologica. 1994 Jul-Aug;79(4):328-33.