In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2009 | 27 | 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) | 3.62 | 10.23 | -45.47 | 1 | 5 | 1 | 53 | 364.421 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 7.33 | -10.1 | 0 | 5 | 0 | 52 | 363.413 | 3 | ↓ |