In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2005 | 28 | No |
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) | 5.15 | 10.74 | -120.89 | 0 | 4 | -2 | 80 | 364.356 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.47 | 10.7 | -57.11 | 0 | 4 | -1 | 74 | 365.364 | 2 | ↓ |