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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H21FN2O3
Molecular Weight 428.4549
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PF-05105679

SMILES

C[C@@H](N(CC1=CC(=CC=C1)C(O)=O)C(=O)C2=CC3=CC=CC=C3N=C2)C4=CC=C(F)C=C4

InChI

InChIKey=BXNMZRPTQFVRFA-QGZVFWFLSA-N
InChI=1S/C26H21FN2O3/c1-17(19-9-11-23(27)12-10-19)29(16-18-5-4-7-21(13-18)26(31)32)25(30)22-14-20-6-2-3-8-24(20)28-15-22/h2-15,17H,16H2,1H3,(H,31,32)/t17-/m1/s1

HIDE SMILES / InChI

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
103.0 nM [IC50]
Name Type Language
PF-05105679
Common Name English
BENZOIC ACID, 3-((((1R)-1-(4-FLUOROPHENYL)ETHYL)(3-QUINOLINYLCARBONYL)AMINO)METHYL)-
Systematic Name English
PF 5105679
Code English
3-((((1R)-1-(4-FLUOROPHENYL)ETHYL)(3-QUINOLINYLCARBONYL)AMINO)METHYL)-BENZOIC ACID
Systematic Name English
Code System Code Type Description
CAS
1398583-31-7
Created by admin on Sat Dec 16 12:01:45 GMT 2023 , Edited by admin on Sat Dec 16 12:01:45 GMT 2023
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EPA CompTox
DTXSID301336742
Created by admin on Sat Dec 16 12:01:45 GMT 2023 , Edited by admin on Sat Dec 16 12:01:45 GMT 2023
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DRUG BANK
DB15450
Created by admin on Sat Dec 16 12:01:45 GMT 2023 , Edited by admin on Sat Dec 16 12:01:45 GMT 2023
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FDA UNII
F2B10OFV7Y
Created by admin on Sat Dec 16 12:01:45 GMT 2023 , Edited by admin on Sat Dec 16 12:01:45 GMT 2023
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PUBCHEM
60195662
Created by admin on Sat Dec 16 12:01:45 GMT 2023 , Edited by admin on Sat Dec 16 12:01:45 GMT 2023
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MANUFACTURER PRODUCT INFORMATION
PF-05105679
Created by admin on Sat Dec 16 12:01:45 GMT 2023 , Edited by admin on Sat Dec 16 12:01:45 GMT 2023
PRIMARY Description: TRPM8 inhibitor (IC50 value 0.1 .MU.M for TRPM8 in single cell patch clamp electrophysiology (Ephys) studies), showing >100-fold selectivity across a range of different receptors, ion channels, and enzymes including the closely related TRPV1 and TRPA1 channels. Although PF-05105679 shows no effect on core body temperature in humans, it proofs to be a useful tool to study in vitro effects of TRPM8 on thermoregulation and for the treatment of pain in humans.
WIKIPEDIA
PF-05105679
Created by admin on Sat Dec 16 12:01:45 GMT 2023 , Edited by admin on Sat Dec 16 12:01:45 GMT 2023
PRIMARY