UCSF

ZINC06092198

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2006 22 No

Popular Name: 6-Hydroxyluteolin 6-Hydroxyluteolin

Find On: PubMed — Wikipedia — Google

CAS Number: 18003-33-3

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) 1.71 -1.79 -24.22 5 7 0 131 302.238 1 ↓
Hi High (pH 8-9.5) 1.71 -1.2 -57.44 4 7 -1 134 301.23 1 ↓
Hi High (pH 8-9.5) 1.71 -0.98 -56.85 4 7 -1 134 301.23 1 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
ALDR-1-E Aldose Reductase (cluster #1 Of 5), Eukaryotic Eukaryotes 204 0.43 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
ALDR_RAT P07943 Aldose Reductase, Rat 204.173794 0.43 Binding ≤ 1μM
ALDR_RAT P07943 Aldose Reductase, Rat 204.173794 0.43 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Pregnenolone biosynthesis

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