General Information of the Compound
| Compound ID |
CP0378067
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| Compound Name |
(5bR,9aS)-1,9,9,10-Tetramethyl-4-trifluoromethyl-1,5b,6,7,8,9,9a,10-octahydro-pyrido[2,3-b]carbazol-2-one
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| Structure |
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| Formula |
C20H23F3N2O
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| Molecular Weight |
364.411
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| Canonical SMILES |
CN1[C@H]2[C@H](CCCC2(C)C)c2cc3c(cc(=O)n(C)c3cc12)C(F)(F)F
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| InChI |
InChI=1S/C20H23F3N2O/c1-19(2)7-5-6-11-12-8-13-14(20(21,22)23)9-17(26)24(3)16(13)10-15(12)25(4)18(11)19/h8-11,18H,5-7H2,1-4H3/t11-,18+/m1/s1
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| InChIKey |
NJDIGNMRUNIBPJ-ZMZPIMSZSA-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