In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 35 | 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) | -1.37 | 8.52 | -91.14 | 3 | 13 | -1 | 210 | 484.397 | 7 | ↓ |
Hi High (pH 8-9.5) | -1.37 | 6.71 | -123.05 | 2 | 13 | -2 | 205 | 483.389 | 7 | ↓ |
Hi High (pH 8-9.5) | -1.37 | 7.55 | -147.64 | 2 | 13 | -2 | 205 | 483.389 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.37 | 6.53 | -68.12 | 4 | 13 | 0 | 207 | 485.405 | 7 | ↓ |