| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 16 | No |
Popular Name: 4-[4-(Aminomethyl)pyridin-2-yl]-1lambda(6),4-thiomorpholine-1,1-dione 4-[4-(Aminomethyl)pyridin-2-yl]-…
Find On: PubMed — Wikipedia — Google
CAS Number: 1153843-40-3
| 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) | -0.46 | 0.51 | -61.44 | 3 | 5 | 1 | 78 | 242.324 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.46 | 0.12 | -12.07 | 2 | 5 | 0 | 76 | 241.316 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
