In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2009 | 26 | Yes |
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) | 3.18 | 6.44 | -43.42 | 2 | 4 | 1 | 32 | 358.55 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.18 | 8.81 | -109.73 | 3 | 4 | 2 | 34 | 359.558 | 6 | ↓ |