In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 13 | 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) | 1.54 | 2.98 | -8.38 | 1 | 4 | 0 | 51 | 242.076 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 2.35 | -38.64 | 0 | 4 | -1 | 49 | 241.068 | 2 | ↓ |