In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2008 | 31 | 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) | 3.33 | 9.6 | -16.52 | 3 | 7 | 0 | 88 | 437.466 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 10.12 | -43.56 | 4 | 7 | 1 | 89 | 438.474 | 8 | ↓ |