In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 15 | 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) | 1.87 | 5.2 | -48.91 | 1 | 4 | -1 | 65 | 227.309 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 5.61 | -60.02 | 2 | 4 | 0 | 66 | 228.317 | 7 | ↓ |