General Information of the Compound
| Compound ID |
CP0884835
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| Compound Name |
(R)-3-Isopropylamino-chroman-5-carboxylic acid amide
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| Structure |
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| Formula |
C13H18N2O2
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| Molecular Weight |
234.299
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| Canonical SMILES |
CC(C)N[C@H]1COc2cccc(C(N)=O)c2C1
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| InChI |
InChI=1S/C13H18N2O2/c1-8(2)15-9-6-11-10(13(14)16)4-3-5-12(11)17-7-9/h3-5,8-9,15H,6-7H2,1-2H3,(H2,14,16)/t9-/m1/s1
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| InChIKey |
FVAVMEQKDWJQEM-SECBINFHSA-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