| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 17 | No |
Popular Name: (1R)-N-methyl-1-[4-methyl-2-(1,4-thiazepan-4-yl)thiazol-5-yl]ethanamine (1R)-N-methyl-1-[4-methyl-2-(1,4…
| 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) | 2.33 | 6.95 | -39.04 | 2 | 3 | 1 | 33 | 272.463 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 5.67 | -5.48 | 1 | 3 | 0 | 28 | 271.455 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
