| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 18 | Yes |
Popular Name: 1-[(1R)-1-(5-tert-butyl-2-methyl-1,2,4-triazol-3-yl)ethyl]piperazine 1-[(1R)-1-(5-tert-butyl-2-methyl…
| 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) | 1.03 | 3.5 | -44.83 | 2 | 5 | 1 | 51 | 252.386 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.03 | 2.14 | -7.69 | 1 | 5 | 0 | 46 | 251.378 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.03 | 4.32 | -87.88 | 3 | 5 | 2 | 52 | 253.394 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
