In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2005 | 16 | Yes |
Popular Name: 4-(2,3-dihydro-1H-indol-1-yl)-4-oxobutanoic acid 4-(2,3-dihydro-1H-indol-1-yl)-4-…
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CAS Numbers: , 105105-00-8 , [105105-00-8]
1H-indole-1-butanoic acid, 2,3-dihydro-g-oxo-
4-(2,3-Dihydro-indol-1-yl)-4-oxo-butyric acid
4-(2,3-Dihydroindol-1-yl)-4-oxo-butyric acid
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) | 0.47 | 5.93 | -49.61 | 0 | 4 | -1 | 60 | 218.232 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |