UCSF

ZINC12501868

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) -3.01 1.86 -72.21 6 6 1 106 203.266 7
Ref Reference (pH 7) -3.01 1.85 -70.95 6 6 1 106 203.266 7
Hi High (pH 8-9.5) -3.01 1.55 -55.74 5 6 0 104 202.258 7
Hi High (pH 8-9.5) -3.01 2.17 -55.6 5 6 0 104 202.258 7

Activity (Go SEA)

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