In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 24 | 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) | 1.08 | 13.11 | -33.87 | 0 | 3 | 1 | 29 | 324.444 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.53 | 12.93 | -9.45 | 0 | 3 | 0 | 30 | 323.436 | 6 | ↓ |