In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 27 | 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) | 3.14 | 6.62 | -13.21 | 1 | 6 | 0 | 66 | 375.444 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.14 | 8.77 | -44.17 | 2 | 6 | 1 | 67 | 376.452 | 5 | ↓ |