| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | Yes |
Popular Name: (7S)-2-isoindolin-2-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-amine (7S)-2-isoindolin-2-yl-4,5,6,7-t…
| 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) | 0.63 | 6.61 | -47.11 | 3 | 3 | 1 | 44 | 272.397 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 6.29 | -6.26 | 2 | 3 | 0 | 42 | 271.389 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.63 | 7.03 | -96.47 | 4 | 3 | 2 | 45 | 273.405 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
