| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 20 | Yes |
Popular Name: N-[[4-(isoindolin-2-ylmethyl)thiazol-2-yl]methyl]propan-1-amine N-[[4-(isoindolin-2-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) | 2.07 | 8.6 | -95.24 | 3 | 3 | 2 | 34 | 289.448 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 4.63 | -6.01 | 1 | 3 | 0 | 28 | 287.432 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 7.24 | -36.1 | 2 | 3 | 1 | 29 | 288.44 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
