| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 18 | Yes |
Popular Name: 4-[[(1S)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]amino]piperidine-1-carboxamide 4-[[(1S)-1-(4-methyl-1,2,4-triaz…
| 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) | -0.62 | 3.03 | -50.58 | 4 | 7 | 1 | 94 | 253.33 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.62 | 2.2 | -15.41 | 3 | 7 | 0 | 89 | 252.322 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
