UCSF

ZINC08234282

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) 5.17 3.16 -0.23 0 0 0 0 204.357 0

Vendor Notes

Note Type Comments Provided By
BP 116 / 10 TCI
UniProt Database Links AMO_ARTAN; CARS_ARTAN; CS_HELAN; GCOA_STRGG; HUMS_ARATH; PENA_STREX; TPS1_MATRE; TPS2_MATRE; TPS6_PHYDL; ZSS1_ZINZE ChEBI

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z102380-1-O Ileum (cluster #1 Of 3), Other Other 1490 0.54 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z102380 Z102380 Ileum 1490 0.54 Functional ≤ 10μM

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