| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2009 | 32 | Yes |
Popular Name: (2S)-4-benzyl-N-(2-dimethylaminoethyl)-1-(3-methoxyphenyl)sulfonyl-piperazine-2-carboxamide (2S)-4-benzyl-N-(2-dimethylamino…
| 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) | 1.70 | 6.19 | -44.85 | 2 | 8 | 1 | 83 | 461.608 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 4.05 | -35.22 | 1 | 8 | 0 | 90 | 460.6 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.70 | 8.12 | -99.46 | 3 | 8 | 2 | 85 | 462.616 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
