| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 20 | Yes |
Popular Name: N-methyl-2-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]sulfonyl-ethanamine N-methyl-2-[(2S)-4-methyl-2-phen…
| 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) | 0.98 | 2.15 | -52.66 | 2 | 5 | 1 | 57 | 298.432 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 0.72 | -8.95 | 1 | 5 | 0 | 53 | 297.424 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 4.53 | -103.94 | 3 | 5 | 2 | 58 | 299.44 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
