UCSF

ZINC28631632

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) -0.81 3.49 -67.31 5 6 0 117 328.368 7
Hi High (pH 8-9.5) -0.81 3.18 -56.66 4 6 -1 115 327.36 7

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0161588A2; EP0198271A2; EP0220665A2; EP0222283A2; EP0262318A2; EP0264795A2; EP0272444A2; EP0286813A2; EP0309841A2; EP0327877A2; EP0330925A2; EP0362274B1; EP0371390A2; EP0454367A2; EP0454367A3; EP0454367B1; EP0475160B1; EP0759772A1; EP0771818A3; EP094850 IBM Patent Data

Activity (Go SEA)

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