In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 27 | 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) | 3.94 | 10.73 | -42.41 | 2 | 5 | 1 | 68 | 368.453 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.94 | 11.5 | -30.85 | 1 | 5 | 0 | 71 | 367.445 | 3 | ↓ |