General Information of the Compound
| Compound ID |
CP0294704
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| Compound Name |
(8R,9S)-9-amino-4-methyl-8-(2,4,5-trifluorophenyl)-9,10-dihydro-8H-pyrano[2,3-h]chromen-2-one
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| Structure |
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| Formula |
C19H14F3NO3
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| Molecular Weight |
361.319
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| Canonical SMILES |
Cc1cc(=O)oc2c3C[C@H](N)[C@H](Oc3ccc12)c1cc(F)c(F)cc1F
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| InChI |
InChI=1S/C19H14F3NO3/c1-8-4-17(24)26-18-9(8)2-3-16-11(18)6-15(23)19(25-16)10-5-13(21)14(22)7-12(10)20/h2-5,7,15,19H,6,23H2,1H3/t15-,19+/m0/s1
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| InChIKey |
MXZDPLKXVPVWMV-HNAYVOBHSA-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