| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 2006 | 25 | No |
Popular Name: 3-[[3-(1-piperidylsulfonyl)phenyl]iminomethyl]benzene-1,2-diol 3-[[3-(1-piperidylsulfonyl)pheny…
| 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) | 2.90 | 3.27 | -13.7 | 2 | 6 | 0 | 90 | 360.435 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 3.04 | -43.97 | 1 | 6 | -1 | 93 | 359.427 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 4.19 | -55.45 | 1 | 6 | -1 | 93 | 359.427 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.90 | 2.55 | -42.9 | 3 | 6 | 1 | 92 | 361.443 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.90 | 3.74 | -41.97 | 3 | 6 | 1 | 92 | 361.443 | 4 | ↓ |
