In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 15 | No |
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) | 2.37 | 5.22 | -6.2 | 0 | 3 | 0 | 27 | 220.297 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 5.76 | -46.2 | 0 | 3 | -1 | 27 | 219.289 | 3 | ↓ |