In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 14 | 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) | 2.18 | 5.86 | -29.13 | 1 | 2 | 1 | 8 | 195.33 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 3.62 | -1.43 | 0 | 2 | 0 | 6 | 194.322 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.18 | 8.07 | -101.27 | 2 | 2 | 2 | 9 | 196.338 | 4 | ↓ |