In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2007 | 15 | 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) | 2.60 | 6 | -10.34 | 1 | 2 | 0 | 29 | 217.293 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.60 | 6.53 | -52.1 | 1 | 2 | -1 | 29 | 216.285 | 2 | ↓ |