| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 20 | Yes |
Popular Name: (7S)-2-isoindolin-2-yl-N-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-amine (7S)-2-isoindolin-2-yl-N-methyl-…
| 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) | 2.88 | 8.35 | -41.3 | 2 | 3 | 1 | 33 | 286.424 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.88 | 6.94 | -7.76 | 1 | 3 | 0 | 28 | 285.416 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.88 | 8.8 | -90.42 | 3 | 3 | 2 | 34 | 287.432 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
