In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 28 | 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) | 2.65 | 3.96 | -42.93 | 5 | 8 | 1 | 122 | 389.428 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.65 | 4.72 | -45.69 | 4 | 8 | 0 | 125 | 388.42 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.65 | 2.77 | -15.2 | 4 | 8 | 0 | 117 | 388.42 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.65 | 4.68 | -44.04 | 4 | 8 | 0 | 125 | 388.42 | 11 | ↓ |