In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | 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) | 0.97 | 4.1 | -54.5 | 3 | 5 | 0 | 86 | 299.124 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 2.83 | -46.78 | 2 | 5 | -1 | 81 | 298.116 | 4 | ↓ |