| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2008 | 10 | Yes |
Popular Name: (3AS,7aR)-5-methyl-2,3,3a,4,7,7a-hexahydro-1H-isoindole (3AS,7aR)-5-methyl-2,3,3a,4,7,7a…
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CAS Number: 21764-64-7
| 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) | 2.17 | 4.53 | -38.14 | 2 | 1 | 1 | 17 | 138.234 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.