In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2008 | 20 | 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) | 0.26 | 3.92 | -113.78 | 4 | 5 | 2 | 60 | 288.432 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 2.66 | -31.7 | 3 | 5 | 1 | 55 | 287.424 | 9 | ↓ |