In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2011 | 23 | No |
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) | 3.50 | 9.1 | -5.89 | 0 | 4 | 0 | 41 | 316.445 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 11.13 | -48.18 | 1 | 4 | 1 | 42 | 317.453 | 7 | ↓ |