In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 34 | 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) | 5.95 | 13.21 | -14.93 | 1 | 6 | 0 | 65 | 498.41 | 9 | ↓ |
Mid Mid (pH 6-8) | 5.95 | 13.7 | -43.55 | 2 | 6 | 1 | 67 | 499.418 | 9 | ↓ |