In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 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) | -0.71 | 1.89 | -105.26 | 3 | 6 | 2 | 62 | 264.395 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.71 | -1.76 | -7.65 | 1 | 6 | 0 | 56 | 262.379 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.71 | -0.38 | -51.23 | 2 | 6 | 1 | 60 | 263.387 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.71 | 0.46 | -44.6 | 2 | 6 | 1 | 57 | 263.387 | 3 | ↓ |