In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2009 | 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) | -0.20 | 0.97 | -41.44 | 3 | 5 | 0 | 86 | 211.217 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.20 | 1.75 | -60.17 | 2 | 5 | -1 | 89 | 210.209 | 5 | ↓ |