In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2009 | 26 | 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) | 2.10 | 5.28 | -46.92 | 2 | 7 | 1 | 76 | 396.924 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 2.92 | -8.9 | 1 | 7 | 0 | 74 | 395.916 | 6 | ↓ |