In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2007 | 36 | 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) | 4.17 | 13.85 | -74.06 | 1 | 9 | 0 | 120 | 495.576 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.59 | 2.6 | -52.82 | 1 | 9 | 1 | 113 | 496.584 | 11 | ↓ |