UCSF

ZINC04962637

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) -0.82 6.92 -319.39 0 8 -4 161 256.166 4
Mid Mid (pH 6-8) -0.82 5.36 -201.37 1 8 -3 158 257.174 4
Lo Low (pH 4.5-6) -0.82 3.16 -102.92 2 8 -2 155 258.182 4

Vendor Notes

Note Type Comments Provided By
MP 271 TCI

Activity (Go SEA)

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