In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 7th, 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) | 2.31 | 4.88 | -3.02 | 0 | 2 | 0 | 12 | 205.301 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.31 | 7.27 | -36.3 | 1 | 2 | 1 | 14 | 206.309 | 2 | ↓ |