In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 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) | 6.69 | 14.98 | -24.41 | 2 | 4 | 0 | 65 | 506.458 | 6 | ↓ |
Mid Mid (pH 6-8) | 7.20 | -1 | -11.17 | 1 | 4 | 0 | 65 | 506.458 | 6 | ↓ |
Mid Mid (pH 6-8) | 7.20 | 0.76 | -18.12 | 1 | 4 | 0 | 65 | 506.458 | 6 | ↓ |
Mid Mid (pH 6-8) | 7.02 | -1.01 | -11.16 | 1 | 4 | 0 | 65 | 506.458 | 6 | ↓ |