| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 16 | Yes |
Popular Name: methyl 3-{[(3,4-difluorophenyl)methyl]amino}propanoate methyl 3-{[(3,4-difluorophenyl)m…
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CAS Number: 1152548-66-7
| 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) | 1.58 | 6.13 | -55.75 | 2 | 3 | 1 | 43 | 230.234 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 4.78 | -8.27 | 1 | 3 | 0 | 38 | 229.226 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
