In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 27 | 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) | 1.28 | 5.33 | -25.11 | 2 | 8 | 0 | 112 | 379.401 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 5.79 | -54.23 | 3 | 8 | 1 | 114 | 380.409 | 5 | ↓ |