| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 15 | Yes |
Popular Name: N-[[4-(pyrrolidin-1-ylmethyl)thiazol-2-yl]methyl]ethanamine N-[[4-(pyrrolidin-1-ylmethyl)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) | 0.98 | 5.61 | -86.96 | 3 | 3 | 2 | 34 | 227.377 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 4.23 | -31.17 | 2 | 3 | 1 | 29 | 226.369 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 1.74 | -4.63 | 1 | 3 | 0 | 28 | 225.361 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
