In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 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) | 1.46 | 7.51 | -37.78 | 1 | 4 | 0 | 58 | 206.245 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 7.13 | -48.59 | 0 | 4 | -1 | 56 | 205.237 | 4 | ↓ |