In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 20 | 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) | 4.24 | 11.3 | -15.74 | 0 | 2 | 0 | 34 | 286.293 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.99 | 10.2 | -46.44 | 0 | 2 | -1 | 40 | 285.285 | 7 | ↓ |