In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 22 | No |
Popular Name: N-(1-butyl-4-piperidyl)-5-nitro-thiophene-2-sulfonamide N-(1-butyl-4-piperidyl)-5-nitro-…
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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) | 2.89 | 5.94 | -47.76 | 2 | 7 | 1 | 96 | 348.47 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.89 | 5.82 | -38.37 | 1 | 7 | 0 | 99 | 347.462 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.