In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 29 | No |
None
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) | 5.12 | 10.44 | -41.83 | 2 | 5 | 1 | 64 | 396.507 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.12 | 11.11 | -29.05 | 1 | 5 | 0 | 67 | 395.499 | 8 | ↓ |