UCSF

ZINC26980973

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2009 21 Yes

Popular Name: 1,2-Dimethoxynoraporphine; 4H-Dibenzo(de,g)quinoline, 5,6,6a,7-tetrahydro-1,2-dimethoxy-, (+-)-; LS-97005; Noraporphine, 1,2-dimethoxy-; Nornuciferine; dl-Nornuciferine 1,2-Dimethoxynoraporphine; 4H-Di…

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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) 3.21 6.54 -6.89 1 3 0 30 281.355 2 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
PTCA-1-E Protein Tyrosine Phosphatase Receptor Type C-associated Protein (cluster #1 Of 1), Eukaryotic Eukaryotes 5300 0.35 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
PTCA_HUMAN Q14761 Protein Tyrosine Phosphatase Receptor Type C-associated Protein, Human 5300 0.35 Binding ≤ 10μM

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