| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 18 | No |
Popular Name: [4-[(4-bromophenyl)methyl-methyl-amino]tetrahydrothiopyran-4-yl]methanol [4-[(4-bromophenyl)methyl-methyl…
| 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 | 6.61 | -39.24 | 2 | 2 | 1 | 25 | 331.299 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 4.52 | -4.38 | 1 | 2 | 0 | 23 | 330.291 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
