In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2009 | 26 | 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) | 3.04 | 10.82 | -13.33 | 0 | 5 | 0 | 59 | 386.546 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.04 | 11.28 | -41.9 | 1 | 5 | 1 | 60 | 387.554 | 7 | ↓ |