| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 17 | No |
Popular Name: (3R)-N-[[2-(ethylaminomethyl)thiazol-4-yl]methyl]-N-methyl-tetrahydrothiophen-3-amine (3R)-N-[[2-(ethylaminomethyl)thi…
| 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) | 1.22 | 6.83 | -95.25 | 3 | 3 | 2 | 34 | 273.471 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 3.14 | -5.31 | 1 | 3 | 0 | 28 | 271.455 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 4.51 | -39.78 | 2 | 3 | 1 | 33 | 272.463 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
