General Information of the Compound
| Compound ID |
CP0787218
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| Compound Name |
N-{(3-exo)-8-[(6-Fluoro-2-naphthyl)methyl]-8-azabicyclo[3.2.1]oct-3-yl}-2-pyridin-4-ylbenzamide
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| Formula |
C30H28FN3O
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| Molecular Weight |
465.572
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| Canonical SMILES |
O=C(N[C@@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc2cc(F)ccc2c1)c1ccccc1-c1ccncc1
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| InChI |
InChI=1S/C30H28FN3O/c31-24-8-7-22-15-20(5-6-23(22)16-24)19-34-26-9-10-27(34)18-25(17-26)33-30(35)29-4-2-1-3-28(29)21-11-13-32-14-12-21/h1-8,11-16,25-27H,9-10,17-19H2,(H,33,35)/t25-,26-,27+
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| InChIKey |
ORBGIALYWQHFBH-OJXFFNQFSA-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