In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 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) | 2.00 | 8.74 | -20.27 | 1 | 6 | 0 | 67 | 386.471 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.00 | 8.87 | -45.72 | 2 | 6 | 1 | 68 | 387.479 | 7 | ↓ |