In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 2nd, 2011 | 26 | No |
Popular Name: N-ethyl-N-[1-[(6-nitroindazol-1-yl)methyl]-4-piperidyl]methanesulfonamide N-ethyl-N-[1-[(6-nitroindazol-1-…
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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) | 1.82 | 5.39 | -16.25 | 0 | 9 | 0 | 104 | 381.458 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.82 | 7.69 | -56.87 | 1 | 9 | 1 | 105 | 382.466 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.