| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 15 | Yes |
Popular Name: 4-chloro-2-{[(pentan-3-yl)amino]methyl}phenol 4-chloro-2-{[(pentan-3-yl)amino]…
Find On: PubMed — Wikipedia — Google
CAS Number: 1019533-55-1
| 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) | 3.84 | 4.98 | -36.99 | 3 | 2 | 1 | 37 | 228.743 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.84 | 5.77 | -27.24 | 2 | 2 | 0 | 40 | 227.735 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
