General Information of the Compound
| Compound ID |
CP0041801
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| Compound Name |
(S)-6-cyclopropyl-9a-ethyl-8,9,9a,10-tetrahydroindeno[2,1-e]indazol-7(3H)-one
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| Structure |
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| Formula |
C19H20N2O
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| Molecular Weight |
292.382
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| Canonical SMILES |
CC[C@]12Cc3c(ccc4[nH]ncc34)C1=C(C1CC1)C(=O)CC2
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| InChI |
InChI=1S/C19H20N2O/c1-2-19-8-7-16(22)17(11-3-4-11)18(19)12-5-6-15-14(10-20-21-15)13(12)9-19/h5-6,10-11H,2-4,7-9H2,1H3,(H,20,21)/t19-/m0/s1
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| InChIKey |
IJPBFHTWSZYEKH-IBGZPJMESA-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