General Information of the Compound
Compound ID
CP0787091
Compound Name
CO-102862
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Synonyms
(E)-2-(4-(4-fluorophenoxy)benz-ylidene)hydrazinecarboxamide
0KN11H90GF
181144-66-1
2-((4-(4-Fluorophenoxy)phenyl)methylene)hydrazinecarboxamide
2-(4-(4-Fluorophenoxy)benzylidene)hydrazinecarboxamide
2-[[4-(4-Fluorophenoxy)phenyl]methylene]hydrazinecarboxamide
4-(4-fluorophenoxy)benzaldehyde semicarbazone
AKOS016004881
BDBM50141073
CHEBI:92156
CHEMBL287833
CO 102862
CO-102862
Hydrazinecarboxamide, 2-((4-(4-fluorophenoxy)phenyl)methylene)-
MolPort-022-863-701
NCGC00167807-01
UNII-0KN11H90GF
V-102862
V102862
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Structure
Formula
C14H12FN3O2
Molecular Weight
273.267
Canonical SMILES
NC(=O)N/N=C/c1ccc(Oc2ccc(F)cc2)cc1
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InChI
InChI=1S/C14H12FN3O2/c15-11-3-7-13(8-4-11)20-12-5-1-10(2-6-12)9-17-18-14(16)19/h1-9H,(H3,16,18,19)/b17-9+
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InChIKey
MHUUDVZSPFRUSK-RQZCQDPDSA-N
Physicochemical Property
logP
2.6202
Rotatable Bonds
4
Heavy Atom Count
20
Polar Areas
76.71
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
20

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 9816959
SID: 14775057
ChEMBL ID
CHEMBL287833
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT03043, Sodium channel protein type 4 subunit alpha
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
Ki = 180 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( V-102862 )
Drug Name V-102862
Target(s)
Voltage-gated sodium channel alpha Nav1.4 (SCN4A)
Inhibitor
Voltage-gated sodium channel alpha Nav1.7 (SCN9A)
Inhibitor