UCSF

ZINC01577023

Annotations

Vendors

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) 2.43 7.74 -49.01 0 2 -1 40 173.191 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 163-167? Alfa-Aesar
Melting_Point 163-167° Alfa-Aesar

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50594-8-O Mus Musculus (cluster #8 Of 9), Other Other 220 0.72 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50594 Z50594 Mus Musculus 220 0.72 Functional ≤ 10μM

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