In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 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) | 1.59 | 4.59 | -42.28 | 2 | 3 | 1 | 34 | 210.297 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 1.91 | -4.78 | 1 | 3 | 0 | 33 | 209.289 | 5 | ↓ |