Drug Name |
CNV-2197944
|
Synonyms |
GSK-2197944; Cav2.2 channel blocker (chronic pain), GlaxoSmithKline/Convergence Pharmaceuticals |
Indication |
Disease Entry |
ICD 11 |
Status |
REF |
Pain |
MG30-MG3Z
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Phase 2 |
[1] |
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Structure |
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3D MOL
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2D MOL
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#Ro5 Violations (Lipinski): 0 |
Molecular Weight (mw) |
427.4 |
|
Logarithm of the Partition Coefficient (xlogp) |
2.6 |
Rotatable Bond Count (rotbonds) |
3 |
Hydrogen Bond Donor Count (hbonddonor) |
0 |
Hydrogen Bond Acceptor Count (hbondacc) |
8 |
Chemical Identifiers |
- Formula
- C19H20F3N3O3S
- IUPAC Name
(2-methylpyridin-3-yl)-[(2S)-2-methyl-4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone
- Canonical SMILES
-
C[C@H]1CN(CCN1C(=O)C2=C(N=CC=C2)C)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F
- InChI
-
InChI=1S/C19H20F3N3O3S/c1-13-12-24(10-11-25(13)18(26)17-4-3-9-23-14(17)2)29(27,28)16-7-5-15(6-8-16)19(20,21)22/h3-9,13H,10-12H2,1-2H3/t13-/m0/s1
- InChIKey
-
BLFJGFDZMABYMY-ZDUSSCGKSA-N
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Cross-matching ID |
- PubChem CID
- 44595848
- CAS Number
-
- DrugBank ID
-
- TTD ID
- D01UDS
- VARIDT ID
- DR01024
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