| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | Yes |
Popular Name: N-methyl-N-[(3R)-1-methyl-3-piperidyl]-5-(propylaminomethyl)thiazol-2-amine N-methyl-N-[(3R)-1-methyl-3-pipe…
| 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) | 2.19 | 8.22 | -83.07 | 3 | 4 | 2 | 37 | 284.473 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 5.84 | -39.75 | 2 | 4 | 1 | 36 | 283.465 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 4.48 | -5.22 | 1 | 4 | 0 | 31 | 282.457 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 6.86 | -37.1 | 2 | 4 | 1 | 33 | 283.465 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
