In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 13 | 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) | 0.40 | 2.88 | -45.83 | 0 | 4 | -1 | 53 | 186.231 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.40 | 4.72 | -32.8 | 1 | 4 | 0 | 54 | 187.239 | 3 | ↓ |