| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 18 | No |
Popular Name: N-[(1R)-1-[(3S)-1-methyl-3-piperidyl]ethyl]-1,1-dioxo-thian-4-amine N-[(1R)-1-[(3S)-1-methyl-3-piper…
| 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) | 1.02 | 4.06 | -120.03 | 3 | 4 | 2 | 55 | 276.446 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 3.12 | -44.88 | 2 | 4 | 1 | 51 | 275.438 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
