| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 23 | Yes |
Popular Name: N-[2-[4-[2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]ethyl]piperazin-1-yl]ethyl]ethanesulfonamide N-[2-[4-[2-[(2S,5R)-2,5-dimethyl…
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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) | 0.86 | 1.82 | -39.5 | 2 | 6 | 1 | 57 | 347.549 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | -0.24 | -10.47 | 1 | 6 | 0 | 56 | 346.541 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | 4.08 | -99.08 | 3 | 6 | 2 | 58 | 348.557 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
