In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 34 | 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) | 0.44 | 3.62 | -16.2 | 2 | 10 | 0 | 109 | 468.558 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 5.95 | -53.75 | 3 | 10 | 1 | 110 | 469.566 | 8 | ↓ |