In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2006 | 33 | 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) | 6.01 | 14.46 | -22.8 | 2 | 4 | 0 | 65 | 472.013 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.52 | 12.8 | -10.86 | 1 | 4 | 0 | 65 | 472.013 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.52 | 13.93 | -17.84 | 1 | 4 | 0 | 65 | 472.013 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.34 | 13.23 | -10.46 | 1 | 4 | 0 | 65 | 472.013 | 6 | ↓ |