In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2009 | 40 | 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) | -5.49 | 11.49 | -206.97 | 1 | 18 | -3 | 261 | 575.504 | 23 | ↓ |
Hi High (pH 8-9.5) | -5.49 | 9.12 | -258.53 | 0 | 18 | -4 | 260 | 574.496 | 23 | ↓ |