Compound Summary


Phaclofen
  Compound Information
 Phaclofen

Compound Name:

Phaclofen

Compound CID:

1641

Synonyms:

Phaclofen

114012-12-3

3-amino-2-(4-chlorophenyl)propylphosphonic acid

108351-35-5

Phosphonic acid, (3-amino-2-(4-chlorophenyl)propyl)-

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Iupac Name:

[3-amino-2-(4-chlorophenyl)propyl]phosphonic acid

InChI:

InChI=1S/C9H13ClNO3P/c10-9-3-1-7(2-4-9)8(5-11)6-15(12,13)14/h1-4,8H,5-6,11H2,(H2,12,13,14)

InChIKey:

VSGNGLJPOGUDON-UHFFFAOYSA-N

Canonical Smiles:

C1=CC(=CC=C1C(CN)CP(=O)(O)O)Cl

Isomeric Smiles:

C1=CC(=CC=C1C(CN)CP(=O)(O)O)Cl

Molecular Weight:

249.63

Molecular Formula:

C9H13ClNO3P

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 Phaclofen

Molecular Weight:

249.63

Molecular Formula:

C9H13ClNO3P

Hydrogen Bond Donor Count:

3

Hydrogen Bond Acceptor Count:

4

Rotatable Bond Count:

4

Heavy Atom Count:

15

Complexity:

238

  Synonyms
 Phaclofen

Phaclofen Phaclofen

Phaclofen

114012-12-3

3-amino-2-(4-chlorophenyl)propylphosphonic acid

108351-35-5

Phosphonic acid, (3-amino-2-(4-chlorophenyl)propyl)-

(3-Amino-2-(4-chlorophenyl)propyl)phosphonic acid

beta-(4-Chlorophenyl)-3-aminopropylphosphonic acid

Phosphonic acid,P-3-amino-2-(4-chlorophenyl)propyl-

Phosphonic acid, P-3-amino-2-(4-chlorophenyl)propyl-

3-Amino-2-(4-chlorophenyl)propylphosphonic acid

SR-01000075640

Phosphonic acid, (3-amino-2-(4-chlorophenyl)propyl)-, (+-)-

Phaclofen, solid

ACMC-20djlx

Biomol-NT_000256

Lopac0_000967

SCHEMBL339995

BPBio1_000970

GTPL1091

CHEMBL1255941

DTXSID80871598

HMS3263A15

Tox21_500967

MFCD00069328

AKOS024418761

CCG-205047

LP00967

MCULE-7710657775

SDCCGSBI-0050940.P002

NCGC00015781-03

NCGC00015781-04

NCGC00015781-05

NCGC00015781-06

NCGC00015781-08

NCGC00024483-02

NCGC00024483-03

NCGC00024483-04

NCGC00261652-01

DB-041194

EU-0100967

FT-0631072

P-118

3-Amino-2-(4-chlorophenyl)propanephosphonic acid

L000482

Ethyl2-(5-methyl-4H-1,2,4-triazol-3-yl)acetate

J-003047

Q7179950

SR-01000075640-1

SR-01000075640-3

(RS)-3-Amino-2-(4-chlorophenyl)propylphosphonic acid

P-a3-aAmino-a2-a(4-achlorophenyl)apropyla-Phosphonic acid

  Experimental Data
 Phaclofen

Species Dose Unit Control(Avg days) Treatment(Avg days) Avg/Med Lifespan Change(%) Control(Max days) Treatment(Max days) Max Lifespan Change(%) Significant Strain Gender PubMed Avg/Med Lifespan Change tab
Caenorhabditis elegans 33.000000000000000 umol/L 6.000000000000000 NS N2 24134630 Inactive
  Experimental Data Visualization
 Phaclofen

  Statistics Data
 Phaclofen

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans 6.000000000000000 1 1
  Statistics Data Visualization
 Phaclofen