In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2010 | 22 | Yes |
Popular Name: [(2S)-tetrahydrofuran-2-yl]-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]methanone [(2S)-tetrahydrofuran-2-yl]-[4-[…
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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) | 1.11 | 4.39 | -15.21 | 0 | 5 | 0 | 42 | 324.343 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.11 | 6.59 | -56.69 | 1 | 5 | 1 | 43 | 325.351 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.