UCSF

ZINC00086067

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 15 No

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) 4.29 6.37 -29.01 0 2 -1 40 282.917 0
Mid Mid (pH 6-8) 3.54 -1.33 -7.26 0 2 0 34 283.925 0

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem
Target DUB Selleck Chemicals

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
UCHL3-1-E Ubiquitin Carboxyl-terminal Hydrolase Isozyme L3 (cluster #1 Of 1), Eukaryotic Eukaryotes 600 0.58 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
UCHL3_HUMAN P15374 Ubiquitin Carboxyl-terminal Hydrolase Isozyme L3, Human 600 0.58 Binding ≤ 1μM
UCHL3_HUMAN P15374 Ubiquitin Carboxyl-terminal Hydrolase Isozyme L3, Human 600 0.58 Binding ≤ 10μM

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

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