UCSF

ZINC49771282

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2010 32 No

Popular Name: JZL 195 JZL 195

Find On: PubMed — Wikipedia — Google

CAS Number: 1210004-12-8

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) 4.54 11.78 -11.64 0 8 0 88 433.464 7 ↓
Mid Mid (pH 6-8) 4.54 14 -56.9 1 8 1 89 434.472 7 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
ABHD6-1-E Monoacylglycerol Lipase ABHD6 (cluster #1 Of 1), Eukaryotic Eukaryotes 50 0.32 Binding ≤ 10μM
FAAH1-1-E Anandamide Amidohydrolase (cluster #1 Of 7), Eukaryotic Eukaryotes 13 0.35 Binding ≤ 10μM
MGLL-2-E Monoglyceride Lipase (cluster #2 Of 7), Eukaryotic Eukaryotes 19 0.34 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
FAAH1_MOUSE O08914 Anandamide Amidohydrolase, Mouse 13 0.35 Binding ≤ 1μM
ABHD6_MOUSE Q8R2Y0 Monoacylglycerol Lipase ABHD6, Mouse 50 0.32 Binding ≤ 1μM
MGLL_MOUSE O35678 Monoglyceride Lipase, Mouse 19 0.34 Binding ≤ 1μM
FAAH1_MOUSE O08914 Anandamide Amidohydrolase, Mouse 13 0.35 Binding ≤ 10μM
ABHD6_MOUSE Q8R2Y0 Monoacylglycerol Lipase ABHD6, Mouse 50 0.32 Binding ≤ 10μM
MGLL_MOUSE O35678 Monoglyceride Lipase, Mouse 19 0.34 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Acyl chain remodeling of DAG and TAG
Arachidonate production from DAG
Hormone-sensitive lipase (HSL)-mediated triacylglycerol hydrolysis

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

No pre-computed analogs available. Try a structural similarity search.