UCSF

ZINC14880028

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) 2.12 6.84 -4.44 0 9 0 137 227.132 3

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 7.78e-02 g/l DrugBank-experimental
Patent Database Links EP1894577; US2008050795 ChEBI
UniProt Database Links GSTU1_ARATH; GSTUO_ARATH; NAMA_BACSU; OPR1_ARATH; OPR2_ARATH; OPR3_ARATH; POLX_TOBAC; TNNI3_BOVIN; TNNI3_CANFA; TNNI3_FELCA; TNNI3_HORSE; TNNI3_HUMAN; TNNI3_MOUSE; TNNI3_RABIT; TNNI3_RAT; TNNT_PERAM; TNT_HUMAN; U73B4_ARATH; U73C1_ARATH ChEBI

Activity (Go SEA)

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