| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 18 | Yes |
Popular Name: 1-[4-(isoindolin-2-ylmethyl)thiazol-2-yl]-N-methyl-methanamine 1-[4-(isoindolin-2-ylmethyl)thia…
| 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) | 1.19 | 6.99 | -94.14 | 3 | 3 | 2 | 34 | 261.394 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.19 | 2.93 | -6.36 | 1 | 3 | 0 | 28 | 259.378 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.19 | 5.55 | -36.36 | 2 | 3 | 1 | 29 | 260.386 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
