In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2011 | 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) | 2.00 | 8.28 | -12.33 | 0 | 6 | 0 | 59 | 354.454 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.00 | 9.06 | -29.06 | 1 | 6 | 0 | 60 | 355.462 | 6 | ↓ |