| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 20 | Yes |
Popular Name: N-[(1R)-1-[4-methyl-2-(4-methyl-1,4-diazepan-1-yl)thiazol-5-yl]ethyl]propan-1-amine N-[(1R)-1-[4-methyl-2-(4-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) | 2.71 | 9.07 | -82.52 | 3 | 4 | 2 | 37 | 298.5 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.71 | 5.89 | -4.6 | 1 | 4 | 0 | 31 | 296.484 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.71 | 7.1 | -37.26 | 2 | 4 | 1 | 36 | 297.492 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
