In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 37 | 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) | 3.86 | 14.45 | -51.38 | 1 | 8 | 1 | 91 | 519.647 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.86 | 12.88 | -21.17 | 0 | 8 | 0 | 90 | 518.639 | 5 | ↓ |