General Information of the Compound
| Compound ID |
CP0917386
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| Compound Name |
1-(3-Aminopropyl)-N-[(3-endo)-9-methyl-9-azabicyclo-[3.3.1]-non-3-yl]-1H-indazole-3-carboxamide
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| Formula |
C20H29N5O
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| Molecular Weight |
355.486
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| Canonical SMILES |
CN1[C@@H]2CCC[C@H]1C[C@@H](NC(=O)c1nn(CCCN)c3ccccc13)C2
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| InChI |
InChI=1S/C20H29N5O/c1-24-15-6-4-7-16(24)13-14(12-15)22-20(26)19-17-8-2-3-9-18(17)25(23-19)11-5-10-21/h2-3,8-9,14-16H,4-7,10-13,21H2,1H3,(H,22,26)/t14-,15+,16-
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| InChIKey |
GSAVAAKDTVSQKT-MUJYYYPQSA-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