General Information of the Compound
Compound ID
CP0393033
Compound Name
Nor-d-fenfluramine
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Synonyms
(+)-norfenfluramine
(S)-norfenfluramine
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Structure
Formula
C10H12F3N
Molecular Weight
203.207
Canonical SMILES
C[C@H](N)Cc1cccc(c1)C(F)(F)F
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InChI
InChI=1S/C10H12F3N/c1-7(14)5-8-3-2-4-9(6-8)10(11,12)13/h2-4,6-7H,5,14H2,1H3/t7-/m0/s1
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InChIKey
MLBHFBKZUPLWBD-ZETCQYMHSA-N
Physicochemical Property
logP
2.5951
Rotatable Bonds
2
Heavy Atom Count
14
Polar Areas
26.02
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
14

"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: 9815618
SID: 14773143
ChEMBL ID
CHEMBL253811
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: PT00825, 5-hydroxytryptamine receptor 2A
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
EC50 = 199.53 nM
   TI
   LI
   LO
   TS
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
EC50 = 15.85 nM
   TI
   LI
   LO
   TS
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
EC50 = 25.12 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( (+)-norfenfluramine )
Drug Name (+)-norfenfluramine
Target(s)
5-HT 2B receptor (HTR2B)
Agonist