In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2009 | 28 | 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) | -0.12 | 1.39 | -48.23 | 6 | 9 | 1 | 138 | 396.512 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.12 | 0.1 | -18.25 | 5 | 9 | 0 | 134 | 395.504 | 8 | ↓ |