In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 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) | 1.47 | 3.98 | -9.17 | 0 | 3 | 0 | 30 | 207.273 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 6.29 | -38.15 | 1 | 3 | 1 | 31 | 208.281 | 6 | ↓ |