In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 22 | 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) | 1.85 | 7.3 | -54.6 | 2 | 4 | 1 | 46 | 297.378 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.85 | 5.93 | -10.69 | 1 | 4 | 0 | 42 | 296.37 | 4 | ↓ |