In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2010 | 34 | 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) | 3.02 | 8.8 | -52.92 | 3 | 7 | 1 | 81 | 478.642 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 7.77 | -54.6 | 3 | 7 | 1 | 84 | 478.642 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 8.21 | -90.11 | 4 | 7 | 2 | 85 | 479.65 | 7 | ↓ |