| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 20 | Yes |
Popular Name: N,N-diethyl-5-[[[(2R)-4-methylmorpholin-2-yl]methylamino]methyl]thiazol-2-amine N,N-diethyl-5-[[[(2R)-4-methylmo…
| 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) | 1.51 | 4.72 | -40.75 | 2 | 5 | 1 | 45 | 299.464 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.51 | 3.29 | -7.21 | 1 | 5 | 0 | 41 | 298.456 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.51 | 5.71 | -40.2 | 2 | 5 | 1 | 42 | 299.464 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.51 | 6.17 | -72.86 | 3 | 5 | 2 | 43 | 300.472 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
