In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2008 | 35 | 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) | 2.59 | 6.2 | -18.21 | 1 | 9 | 0 | 90 | 483.565 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 8.46 | -55.42 | 2 | 9 | 1 | 91 | 484.573 | 9 | ↓ |