In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 12 | Yes |
Popular Name: 1-(azetidin-3-yl)-4-methoxypiperidine dihydrochloride 1-(azetidin-3-yl)-4-methoxypiper…
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CAS Number: 178311-60-9
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) | -0.38 | 0.67 | -39.02 | 2 | 3 | 1 | 29 | 171.264 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.38 | -1.02 | -2.71 | 1 | 3 | 0 | 24 | 170.256 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.38 | 2.85 | -113.11 | 3 | 3 | 2 | 30 | 172.272 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.38 | 1.16 | -33.92 | 2 | 3 | 1 | 26 | 171.264 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.