| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2009 | 21 | Yes |
Popular Name: [2-(benzenesulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methanamine [2-(benzenesulfonyl)-1,2,3,4-tet…
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CAS Numbers: 1193387-94-8 , 1193388-01-0
| 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) | 1.63 | 5.17 | -46.05 | 3 | 4 | 1 | 65 | 303.407 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.63 | 4.73 | -9.26 | 2 | 4 | 0 | 63 | 302.399 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
