In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2006 | 31 | Yes |
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) | 5.76 | 15.01 | -49.81 | 1 | 4 | 1 | 44 | 416.472 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.76 | 12.13 | -10.12 | 0 | 4 | 0 | 43 | 415.464 | 4 | ↓ |