In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2006 | 26 | No |
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) | 1.66 | 2.69 | -11.04 | 3 | 7 | 0 | 110 | 345.362 | 3 | ↓ |
Ref Reference (pH 7) | 1.66 | 2.02 | -10.32 | 3 | 7 | 0 | 110 | 345.362 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.66 | 2.48 | -37.59 | 4 | 7 | 1 | 111 | 346.37 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.66 | 3.15 | -37.36 | 4 | 7 | 1 | 111 | 346.37 | 3 | ↓ |