In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 28 | Yes |
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) | 1.52 | 8.22 | -15.48 | 1 | 7 | 0 | 80 | 395.85 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.52 | 8.69 | -49.75 | 2 | 7 | 1 | 81 | 396.858 | 5 | ↓ |