In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2004 | 13 | No |
Popular Name: Cyclohexanone, 4-(3-methyl-1-oxo-2-butenyl)- (9CI) Cyclohexanone, 4-(3-methyl-1-oxo…
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CAS Number: 412946-63-5
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) | 1.64 | 1.99 | -8.39 | 0 | 2 | 0 | 34 | 180.247 | 2 | ↓ |