Drug Information

Drug General Information
Drug ID
D0VX6J
Former ID
DNC001010
Drug Name
New analgesic drugs
Drug Type
Small molecular drug
Indication Discovery agent Investigative [534980]
Structure
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2D MOL

3D MOL
Formula
C32H39ClN6O7S
Canonical SMILES
CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C34CC5CC(C3)CC4C5.C1=C<br />OC(=C1)CNC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl
InChI
1S/C20H28N4O2.C12H11ClN2O5S/c1-3-5-23-16-15(17(25)24(6-4-2)19(23)26)21-18(22-16)20-10-12-7-13(11-20)9-14(20)8-12;13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h12-14H,3-11H2,1-2H3,(H,21,22);1-5,15H,6H2,(H,16,17)(H2,14,18,19)
InChIKey
LLLIKHLUUMWXPN-UHFFFAOYSA-N
CAS Number
CAS 136199-02-5
PubChem Compound ID
9831419
PubChem Substance ID
14790564, 44929537, 79468804, 134339068, 134339093, 134340278
Target and Pathway
Target(s) PN3 Na+ channel Target Info Binder [534980]
References
Ref 534980Pathobiology of visceral pain: molecular mechanisms and therapeutic implications. II. Genetic approaches to pain therapy. Am J Physiol Gastrointest Liver Physiol. 2000 Apr;278(4):G507-12.
Ref 534980Pathobiology of visceral pain: molecular mechanisms and therapeutic implications. II. Genetic approaches to pain therapy. Am J Physiol Gastrointest Liver Physiol. 2000 Apr;278(4):G507-12.

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