In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2008 | 33 | No |
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) | 2.56 | 11.04 | -79.29 | 1 | 8 | 0 | 96 | 456.539 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 10.3 | -51.07 | 2 | 8 | 1 | 94 | 457.547 | 10 | ↓ |