| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | Yes |
Popular Name: (1S)-N-ethyl-1-(2-isoindolin-2-ylthiazol-5-yl)ethanamine (1S)-N-ethyl-1-(2-isoindolin-2-y…
| 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) | 2.81 | 8.21 | -38.99 | 2 | 3 | 1 | 33 | 274.413 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 7.04 | -5.98 | 1 | 3 | 0 | 28 | 273.405 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
