In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2004 | 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) | 3.38 | 4.45 | -14.05 | 1 | 6 | 0 | 78 | 358.419 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 4.47 | -49.82 | 0 | 6 | -1 | 80 | 357.411 | 6 | ↓ |