In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 15 | 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) | 3.31 | 6.63 | -4.29 | 0 | 2 | 0 | 27 | 206.333 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.31 | 8.5 | -41.27 | 1 | 2 | 1 | 28 | 207.341 | 2 | ↓ |