In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2007 | 27 | Yes |
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) | 4.05 | 10.75 | -46.72 | 1 | 5 | 1 | 53 | 366.437 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.05 | 7.79 | -10.82 | 0 | 5 | 0 | 52 | 365.429 | 5 | ↓ |