| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 22 | No |
Popular Name: (3R,5R)-3,5-dimethyl-N-[(2-nitrophenyl)methyl]piperidine-1-sulfonamide (3R,5R)-3,5-dimethyl-N-[(2-nitro…
| 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) | 2.41 | 5.21 | -15.47 | 1 | 7 | 0 | 95 | 327.406 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.41 | 5.27 | -51.79 | 0 | 7 | -1 | 97 | 326.398 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
