In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 18 | 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) | 0.98 | 4.47 | -35.49 | 1 | 4 | 1 | 26 | 255.382 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 2.06 | -3.03 | 0 | 4 | 0 | 25 | 254.374 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 5.96 | -98.5 | 2 | 4 | 2 | 27 | 256.39 | 2 | ↓ |