| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 15 | No |
Popular Name: [4-[[(3R)-3-methylthiomorpholin-4-yl]methyl]thiazol-2-yl]methanamine [4-[[(3R)-3-methylthiomorpholin-…
| 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) | 0.54 | 1.58 | -45.4 | 3 | 3 | 1 | 44 | 244.409 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.54 | 1.17 | -6.14 | 2 | 3 | 0 | 42 | 243.401 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.54 | 3.62 | -96.37 | 4 | 3 | 2 | 45 | 245.417 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
