In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2006 | 18 | 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) | 3.04 | 5.28 | -46.18 | 1 | 3 | -1 | 60 | 237.234 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 1.28 | -16.32 | 1 | 3 | 0 | 54 | 238.242 | 1 | ↓ |