In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 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) | 2.83 | 6.1 | -37.23 | 2 | 2 | 1 | 20 | 233.379 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.83 | 4.97 | -1.68 | 1 | 2 | 0 | 15 | 232.371 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.83 | 7.21 | -33.35 | 2 | 2 | 1 | 16 | 233.379 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.83 | 8.36 | -113.66 | 3 | 2 | 2 | 21 | 234.387 | 3 | ↓ |