General Information of the Compound
| Compound ID |
CP0405679
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| Compound Name |
N-[1-[(4-chlorophenyl)methyl]pyrrolidin-3-yl]-1H-indazol-5-amine
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| Structure |
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| Formula |
C18H19ClN4
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| Molecular Weight |
326.831
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| Canonical SMILES |
Clc1ccc(CN2CCC(C2)Nc2ccc3[nH]ncc3c2)cc1
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| InChI |
InChI=1S/C18H19ClN4/c19-15-3-1-13(2-4-15)11-23-8-7-17(12-23)21-16-5-6-18-14(9-16)10-20-22-18/h1-6,9-10,17,21H,7-8,11-12H2,(H,20,22)
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| InChIKey |
VYZJFSWYQODVMI-UHFFFAOYSA-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