| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 18 | Yes |
Popular Name: (1S)-1-(2-isoindolin-2-ylthiazol-5-yl)-N-methyl-ethanamine (1S)-1-(2-isoindolin-2-ylthiazol…
| 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) | 2.44 | 7.36 | -40.46 | 2 | 3 | 1 | 33 | 260.386 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 6.09 | -5.25 | 1 | 3 | 0 | 28 | 259.378 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
