In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2008 | 19 | 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) | 1.00 | 1.38 | -17.99 | 0 | 5 | 0 | 53 | 254.293 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.00 | 1.66 | -45.14 | 1 | 5 | 1 | 54 | 255.301 | 4 | ↓ |