In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 17 | 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) | 1.48 | 2.47 | -35.66 | 4 | 4 | 1 | 60 | 240.371 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.48 | 3.72 | -112.81 | 5 | 4 | 2 | 64 | 241.379 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.48 | 2.28 | -41.17 | 4 | 4 | 1 | 63 | 240.371 | 3 | ↓ |