In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2009 | 42 | 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) | 6.33 | 16.61 | -60.43 | 0 | 11 | -1 | 132 | 567.626 | 14 | ↓ |
Mid Mid (pH 6-8) | 6.33 | 16.82 | -56.99 | 1 | 11 | 0 | 134 | 568.634 | 14 | ↓ |
Lo Low (pH 4.5-6) | 6.33 | 16.7 | -22.61 | 1 | 11 | 0 | 134 | 568.634 | 14 | ↓ |
Lo Low (pH 4.5-6) | 6.33 | 16.95 | -42.64 | 2 | 11 | 1 | 135 | 569.642 | 14 | ↓ |