In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 28 | 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) | 2.82 | 8.53 | -11.27 | 1 | 5 | 0 | 53 | 387.499 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.82 | 10.46 | -41.73 | 2 | 5 | 1 | 54 | 388.507 | 6 | ↓ |