UCSF

ZINC34943953

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) -5.04 4.76 -142.34 3 10 -2 176 386.316 4
Hi High (pH 8-9.5) -5.04 5.69 -188.49 2 10 -3 179 385.308 4
Hi High (pH 8-9.5) -5.04 6.36 -104.55 3 10 -2 183 386.316 4
Lo Low (pH 4.5-6) -5.04 2.78 -74.99 4 10 -1 173 387.324 4

Activity (Go SEA)

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