| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 16 | No |
Popular Name: (1S)-1-[4-methyl-2-(1,4-thiazepan-4-yl)thiazol-5-yl]ethanamine (1S)-1-[4-methyl-2-(1,4-thiazepa…
| 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) | 0.08 | 5.25 | -44.44 | 3 | 3 | 1 | 44 | 258.436 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.08 | 4.92 | -5.6 | 2 | 3 | 0 | 42 | 257.428 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
