In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 30 | 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) | 3.83 | 11.17 | -14.33 | 1 | 6 | 0 | 67 | 410.562 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.83 | 11.53 | -33.93 | 2 | 6 | 1 | 68 | 411.57 | 5 | ↓ |