General Information of the Compound
| Compound ID |
CP0785159
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| Compound Name |
N-{(3-exo)-8-[(6-Fluoro-2-naphthyl)methyl]-8-azabicyclo[3.2.1]oct-3-yl}-2-(1H-imidazol-1-yl)benzamide
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| Formula |
C28H27FN4O
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| Molecular Weight |
454.549
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| Canonical SMILES |
O=C(N[C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc2cc(F)ccc2c1)c1ccccc1-n1ccnc1
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| InChI |
InChI=1S/C28H27FN4O/c29-22-8-7-20-13-19(5-6-21(20)14-22)17-33-24-9-10-25(33)16-23(15-24)31-28(34)26-3-1-2-4-27(26)32-12-11-30-18-32/h1-8,11-14,18,23-25H,9-10,15-17H2,(H,31,34)/t23-,24-,25+
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| InChIKey |
GHOPIVHPZQWVRR-MPIKPJSNSA-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