In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2005 | 11 | 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) | 0.40 | 2.62 | -7.3 | 4 | 5 | 0 | 81 | 153.189 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.40 | 2.86 | -25.54 | 5 | 5 | 1 | 82 | 154.197 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.40 | 3.01 | -88.18 | 6 | 5 | 2 | 84 | 155.205 | 1 | ↓ |