UCSF

ZINC34837778

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 27 Yes

Popular Name: 4-[3-(4-fluorophenyl)-1,2,4-thiadiazol-5-yl]-N-phenyl-piperazine-1-carboxamide 4-[3-(4-fluorophenyl)-1,2,4-thia…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.08 9.98 -12.87 1 6 0 61 383.452 3 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
FAAH1-1-E Anandamide Amidohydrolase (cluster #1 Of 7), Eukaryotic Eukaryotes 117 0.36 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
FAAH1_RAT P97612 Anandamide Amidohydrolase, Rat 117 0.36 Binding ≤ 1μM
FAAH1_HUMAN O00519 Anandamide Amidohydrolase, Human 833 0.32 Binding ≤ 1μM
FAAH1_RAT P97612 Anandamide Amidohydrolase, Rat 117 0.36 Binding ≤ 10μM
FAAH1_HUMAN O00519 Anandamide Amidohydrolase, Human 833 0.32 Binding ≤ 10μM

Analogs ( Draw Identity 99% 90% 80% 70% )