In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 16 | 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) | 2.40 | 7.14 | -58.78 | 2 | 4 | 0 | 70 | 216.24 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 6.67 | -50.94 | 1 | 4 | -1 | 69 | 215.232 | 2 | ↓ |