| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 18 | Yes |
Popular Name: 4-Chloro-2-{[(1-phenylethyl)amino]methyl}phenol 4-Chloro-2-{[(1-phenylethyl)amin…
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CAS Number: [1019567-97-5]
| 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) | 4.05 | 6.73 | -40.9 | 3 | 2 | 1 | 37 | 262.76 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.05 | 5.39 | -5.96 | 2 | 2 | 0 | 32 | 261.752 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.05 | 7.51 | -27.87 | 2 | 2 | 0 | 40 | 261.752 | 4 | ↓ |
