General Information of the Compound
Compound ID
CP0150270
Compound Name
Amperozide
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Synonyms
0M2W3TAG39
1-Piperazinecarboxamide, 4-(4,4-bis(p-fluorophenyl)butyl)-N-ethyl-
4-(4,4-Bis(4-fluorophenyl)butyl)-N-ethylpiperazine-1-carboxamide
4-(4,4-Bis(4-fluorphenyl)butyl)-N-ethyl-1-piperazinecarboxamid
4-(4,4-Bis(p-fluorophenyl)butyl)-N-ethyl-1-piperazinecarboxamide
4-[4,4-bis(4-fluorophenyl)butyl]-n-ethylpiperazine-1-carboxamide
75558-90-6
AMPEROZIDE
Amperozida
Amperozida [INN-Spanish]
Amperozide
Amperozide [BAN:INN]
Amperozide [INN:BAN]
Amperozidum
Amperozidum [INN-Latin]
CHEMBL1079935
FG 5606
UNII-0M2W3TAG39
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Structure
Formula
C23H29F2N3O
Molecular Weight
401.501
Canonical SMILES
CCNC(=O)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1
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InChI
InChI=1S/C23H29F2N3O/c1-2-26-23(29)28-16-14-27(15-17-28)13-3-4-22(18-5-9-20(24)10-6-18)19-7-11-21(25)12-8-19/h5-12,22H,2-4,13-17H2,1H3,(H,26,29)
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InChIKey
NNAIYOXJNVGUOM-UHFFFAOYSA-N
Physicochemical Property
logP
4.224
Rotatable Bonds
7
Heavy Atom Count
29
Polar Areas
35.58
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
29

"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: 73333
SID: 12013735
ChEMBL ID
CHEMBL1079935
DrugBank ID
DB08927
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: PT01065, Serine/threonine-protein kinase mTOR
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL001056 MEF-1 [Mouse fibroblast]
 Cell Line Info 
Mus musculus (Mouse)  1
1
Potency = 23280.9 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( AMPEROZIDE )
Drug Name AMPEROZIDE
Indication
Alcohol dependence
Terminated
Target(s)
5-HT 2A receptor (HTR2A)
 Target Info 
Modulator