In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2006 | 25 | 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) | 2.65 | 9.23 | -25.68 | 1 | 8 | 0 | 121 | 405.208 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 7.81 | -38.38 | 0 | 8 | -1 | 127 | 404.2 | 3 | ↓ |