In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 2nd, 2011 | 25 | Yes |
Popular Name: N-[1-[(3-tert-butyl-6-oxo-pyridazin-1-yl)methyl]-4-piperidyl]-N-ethyl-methanesulfonamide N-[1-[(3-tert-butyl-6-oxo-pyrida…
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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) | 1.88 | 6.58 | -46.23 | 1 | 7 | 1 | 77 | 371.527 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 4.22 | -15.23 | 0 | 7 | 0 | 76 | 370.519 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.