In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 16 | Yes |
Popular Name: 3-Acetyl-2,6,6-trimethyl-6,7-dihydro-1-benzothiophen-4(5H)-one 3-Acetyl-2,6,6-trimethyl-6,7-dih…
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CAS Number: 1215635-35-0
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) | 2.81 | 7.39 | -14.94 | 0 | 2 | 0 | 34 | 236.336 | 1 | ↓ |