In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 29 | No |
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) | -0.76 | 3.88 | -55.83 | 3 | 8 | -1 | 128 | 395.391 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.57 | 1.84 | -69.42 | 3 | 8 | -1 | 139 | 395.391 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.76 | 4.96 | -46.15 | 4 | 8 | 0 | 132 | 396.399 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.76 | 4.39 | -38.43 | 4 | 8 | 0 | 132 | 396.399 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.57 | 2.58 | -77.6 | 3 | 8 | -1 | 139 | 395.391 | 5 | ↓ |