General Information of the Compound
| Compound ID |
CP0547161
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| Compound Name |
2-(3-Hydroxy-pyrrolidin-1-yl)-benzo[h]chromen-4-one
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| Structure |
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| Formula |
C17H15NO3
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| Molecular Weight |
281.311
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| Canonical SMILES |
OC1CCN(C1)c1cc(=O)c2ccc3ccccc3c2o1
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| InChI |
InChI=1S/C17H15NO3/c19-12-7-8-18(10-12)16-9-15(20)14-6-5-11-3-1-2-4-13(11)17(14)21-16/h1-6,9,12,19H,7-8,10H2
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| InChIKey |
PDLACESCNWHSFX-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound