In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 24 | 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) | -0.15 | 4.02 | -38.13 | 1 | 7 | 1 | 62 | 350.468 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.15 | 3.62 | -15.22 | 0 | 7 | 0 | 61 | 349.46 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.15 | 6.36 | -112.11 | 2 | 7 | 2 | 64 | 351.476 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.15 | 5.82 | -44.21 | 1 | 7 | 1 | 62 | 350.468 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.15 | 6.22 | -91.98 | 2 | 7 | 2 | 64 | 351.476 | 4 | ↓ |