General Information of the Compound
| Compound ID |
CP0563526
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| Compound Name |
1'-[[5-(aminomethyl)-1-(3-methylbutyl)benzimidazol-2-yl]methyl]-7'-fluorospiro[cyclopropane-1,3'-indole]-2'-one
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| Formula |
C24H27FN4O
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| Molecular Weight |
406.505
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| Canonical SMILES |
CC(C)CCn1c(CN2C(=O)C3(CC3)c3cccc(F)c23)nc2cc(CN)ccc12
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| InChI |
InChI=1S/C24H27FN4O/c1-15(2)8-11-28-20-7-6-16(13-26)12-19(20)27-21(28)14-29-22-17(4-3-5-18(22)25)24(9-10-24)23(29)30/h3-7,12,15H,8-11,13-14,26H2,1-2H3
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| InChIKey |
WPFHBMNLWXTXFJ-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