UCSF

ZINC01532739

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) -2.78 -10.53 -9 5 6 0 110 180.156 1

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 1.121 Bitter DB
ALOGPS_SOLUBILITY 1.19e+03 g/l DrugBank-experimental
Mp [°C] 158 - 160 Acros Organics
MP 165 TCI
UniProt Database Links AMML_ASTMO; DCXR_CAEEL; DCXR_HYPJE; DHSO1_YEAST; DHSO2_YEAST; DHSO_ARATH; DHSO_BACHD; DHSO_BACSU; DHSO_BOMMO; DHSO_BOVIN; DHSO_HUMAN; DHSO_MACFA; DHSO_MOUSE; DHSO_PIG; DHSO_PONAB; DHSO_RAT; DHSO_RHOSH; DHSO_SCHPO; DHSO_SHEEP; GHRB_ECOLI; P2OX_PHACH; P2OX_ ChEBI

Activity (Go SEA)

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