In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 34 | 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) | 6.95 | 11.83 | -21.14 | 2 | 6 | 0 | 87 | 490.654 | 7 | ↓ |
Mid Mid (pH 6-8) | 7.40 | 10.49 | -52.41 | 1 | 6 | -1 | 90 | 489.646 | 7 | ↓ |