In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 23 | 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) | 1.91 | 10.7 | -14.37 | 0 | 7 | 0 | 79 | 320.393 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 11.18 | -51.35 | 1 | 7 | 1 | 80 | 321.401 | 8 | ↓ |