| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2008 | 25 | Yes |
Popular Name: (4-benzylpiperazino)[3-(trifluoromethyl)-2-pyridinyl]methanone (4-benzylpiperazino)[3-(trifluor…
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CAS Number: 1092345-60-2
| 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) | 2.73 | 7.58 | -11.63 | 0 | 4 | 0 | 36 | 349.356 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 9.91 | -45.73 | 1 | 4 | 1 | 38 | 350.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
