In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2011 | 26 | Yes |
Popular Name: 5-methoxy-3-[1-[3-(2,2,2-trifluoroethoxy)propyl]-4-piperidyl]-1H-indole 5-methoxy-3-[1-[3-(2,2,2-trifluo…
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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) | 3.70 | 9.48 | -46.69 | 2 | 4 | 1 | 39 | 371.423 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.70 | 7.24 | -9.45 | 1 | 4 | 0 | 37 | 370.415 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.