In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 11 | Yes |
None
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) | -2.13 | 2.86 | -46.44 | 3 | 4 | 0 | 71 | 160.217 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.13 | 0.79 | -43.56 | 2 | 4 | -1 | 69 | 159.209 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.13 | 1.24 | -32.29 | 3 | 4 | 0 | 71 | 160.217 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.13 | 3.16 | -80.89 | 4 | 4 | 1 | 72 | 161.225 | 5 | ↓ |