In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2008 | 24 | No |
None
None
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) | 2.04 | 10.28 | -42.21 | 2 | 6 | 1 | 56 | 352.459 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.04 | 7.85 | -20.55 | 1 | 6 | 0 | 55 | 351.451 | 6 | ↓ |