| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2009 | 19 | Yes |
Popular Name: 4-[[3-(aminomethyl)phenyl]methylsulfonyl]piperazin-2-one 4-[[3-(aminomethyl)phenyl]methyl…
| 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) | -0.06 | -0.74 | -54.23 | 4 | 6 | 1 | 94 | 284.361 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.06 | -1.14 | -15.31 | 3 | 6 | 0 | 93 | 283.353 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
