In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2009 | 25 | 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) | 1.56 | 6.23 | -17.73 | 1 | 6 | 0 | 69 | 360.483 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 7.72 | -77.9 | 2 | 6 | 1 | 70 | 361.491 | 2 | ↓ |