In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2005 | 21 | No |
Popular Name: 2-(3,4-Dimethoxyphenyl)-1H-indene-1,3(2H)-dione 2-(3,4-Dimethoxyphenyl)-1H-inden…
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CAS Numbers: , 1470-38-8 , [1470-38-8]
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) | 3.19 | 7.32 | -45.74 | 0 | 4 | -1 | 59 | 281.287 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.51 | 7.3 | -11.49 | 0 | 4 | 0 | 53 | 282.295 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |