In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2011 | 16 | Yes |
None
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) | 1.72 | 3.85 | -34.54 | 4 | 4 | 1 | 69 | 211.248 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 3.79 | -8.87 | 3 | 4 | 0 | 68 | 210.24 | 1 | ↓ |