In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2008 | 11 | 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) | -1.40 | 2.44 | -16.25 | 3 | 6 | 0 | 93 | 151.129 | 0 | ↓ |
Mid Mid (pH 6-8) | -1.40 | 2.86 | -56.42 | 4 | 6 | 1 | 94 | 152.137 | 0 | ↓ |
Lo Low (pH 4.5-6) | -1.40 | 2.66 | -46.18 | 4 | 6 | 1 | 94 | 152.137 | 0 | ↓ |
Lo Low (pH 4.5-6) | -1.40 | 3.12 | -121.35 | 5 | 6 | 2 | 96 | 153.145 | 0 | ↓ |