| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 16 | Yes |
Popular Name: (3S)-1-ethyl-N-[(1-methyltriazol-4-yl)methyl]piperidin-3-amine (3S)-1-ethyl-N-[(1-methyltriazol…
| 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) | 0.45 | 3.44 | -37.97 | 2 | 5 | 1 | 47 | 224.332 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.45 | 4.63 | -111.16 | 3 | 5 | 2 | 52 | 225.34 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
