In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 34 | 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) | 4.61 | 14.91 | -10.04 | 0 | 8 | 0 | 90 | 460.534 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.61 | 14.89 | -37.97 | 1 | 8 | 1 | 91 | 461.542 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.61 | 14.89 | -38 | 1 | 8 | 1 | 91 | 461.542 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.61 | 15.37 | -42.8 | 1 | 8 | 1 | 91 | 461.542 | 4 | ↓ |