In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2011 | 40 | 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) | -5.43 | -6.83 | -155.53 | 14 | 20 | 0 | 349 | 574.552 | 19 | ↓ |
Mid Mid (pH 6-8) | -5.43 | -7.19 | -120.27 | 13 | 20 | -1 | 347 | 573.544 | 19 | ↓ |
Lo Low (pH 4.5-6) | -5.43 | -8.77 | -110.92 | 15 | 20 | 1 | 346 | 575.56 | 19 | ↓ |
Lo Low (pH 4.5-6) | -5.43 | -8.82 | -116.34 | 15 | 20 | 1 | 346 | 575.56 | 19 | ↓ |