| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 15 | Yes |
Popular Name: 1-{[(3-chloro-4-fluorophenyl)methyl]amino}-2-methylpropan-2-ol 1-{[(3-chloro-4-fluorophenyl)met…
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CAS Number: 1249603-67-5
| 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) | 2.44 | 4.08 | -44.26 | 3 | 2 | 1 | 37 | 232.706 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 2.99 | -4.01 | 2 | 2 | 0 | 32 | 231.698 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
