UCSF

ZINC30691625

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) 2.81 6.48 -57.72 2 7 -1 108 431.505 11
Hi High (pH 8-9.5) 1.62 3.15 -94.88 7 10 2 148 464.574 7
Lo Low (pH 4.5-6) 2.81 5.36 -17.18 3 7 0 105 432.513 11

Activity (Go SEA)

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