In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 15 | 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) | 1.83 | 1.7 | -3.55 | 1 | 3 | 0 | 33 | 215.337 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 3.86 | -34.06 | 2 | 3 | 1 | 34 | 216.345 | 6 | ↓ |