In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2006 | 21 | 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) | 6.20 | 11.69 | -22.98 | 1 | 1 | 1 | 14 | 272.371 | 1 | ↓ |
Mid Mid (pH 6-8) | 6.20 | 11.37 | -10.37 | 0 | 1 | 0 | 13 | 271.363 | 1 | ↓ |