General Information of the Compound
| Compound ID |
CP0376669
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| Compound Name |
N-[(1S)-3-[2'-(2-methylbenzimidazol-1-yl)spiro[7-azabicyclo[2.2.1]heptane-2,1'-cyclopropane]-7-yl]-1-phenylpropyl]cyclobutanecarboxamide
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| Structure |
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| Formula |
C30H36N4O
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| Molecular Weight |
468.645
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| Canonical SMILES |
Cc1nc2ccccc2n1C1CC11CC2CCC1N2CC[C@H](NC(=O)C1CCC1)c1ccccc1
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| InChI |
InChI=1S/C30H36N4O/c1-20-31-25-12-5-6-13-26(25)34(20)28-19-30(28)18-23-14-15-27(30)33(23)17-16-24(21-8-3-2-4-9-21)32-29(35)22-10-7-11-22/h2-6,8-9,12-13,22-24,27-28H,7,10-11,14-19H2,1H3,(H,32,35)/t23?,24-,27?,28?,30?/m0/s1
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| InChIKey |
BJENQUZWMHDDIJ-GVCKKYRWSA-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