| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2009 | 19 | Yes |
Popular Name: (1R)-1-(2-tert-butyl-4-methyl-thiazol-5-yl)-N-(4H-1,2,4-triazol-3-ylmethyl)ethanamine (1R)-1-(2-tert-butyl-4-methyl-th…
| 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) | 1.84 | 6.23 | -40.52 | 3 | 5 | 1 | 71 | 280.421 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 5.03 | -10.78 | 2 | 5 | 0 | 66 | 279.413 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.84 | 6.08 | -33.97 | 2 | 5 | 0 | 69 | 279.413 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
