| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2010 | 19 | Yes |
Popular Name: 2-bromo-6-[[(1-cyclopropyl-4-piperidyl)amino]methyl]phenol 2-bromo-6-[[(1-cyclopropyl-4-pip…
| 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) | 2.78 | 5.58 | -33.21 | 3 | 3 | 1 | 37 | 326.258 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 6.32 | -48.08 | 2 | 3 | 0 | 40 | 325.25 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 5.42 | -30.36 | 2 | 3 | 0 | 43 | 325.25 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.78 | 6.79 | -107.47 | 4 | 3 | 2 | 41 | 327.266 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
