UCSF

ZINC00007253

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 15 Yes

Popular Name: NS-2028 NS-2028

Find On: PubMed — Wikipedia — Google

CAS Number: 204326-43-2

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) 1.63 5.25 -11.51 0 5 0 57 269.054 0 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
ANPRA-1-E Atrial Natriuretic Peptide Receptor A (cluster #1 Of 1), Eukaryotic Eukaryotes 36 0.69 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
ANPRA_HUMAN P16066 Atrial Natriuretic Peptide Receptor A, Human 36 0.69 Binding ≤ 1μM
ANPRA_HUMAN P16066 Atrial Natriuretic Peptide Receptor A, Human 36 0.69 Binding ≤ 10μM

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

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