UCSF

ZINC13675955

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2008 17 Yes

Popular Name: DNC013239 DNC013239

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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) -0.22 2.47 -45.88 4 5 1 77 242.343 5 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
TPP2-1-E Tripeptidyl Aminopeptidase (cluster #1 Of 1), Eukaryotic Eukaryotes 80 0.58 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
TPP2_RAT Q64560 Tripeptidyl Aminopeptidase, Rat 80 0.58 Binding ≤ 1μM
TPP2_RAT Q64560 Tripeptidyl Aminopeptidase, Rat 80 0.58 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Antigen processing: Ubiquitination & Proteasome degradation

Rings

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