In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 21 | 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) | 4.01 | 10.48 | -44.64 | 2 | 3 | 1 | 33 | 286.443 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.01 | 10.97 | -93.25 | 3 | 3 | 2 | 34 | 287.451 | 8 | ↓ |