General Information of the Compound
| Compound ID |
CP0373712
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| Compound Name |
3-benzyl-1-(2-fluoro-benzyl)-8-(4-imidazol-1-yl-benzyl)-1,3,8-triaza-spiro[4.5]decane-2,4-dione
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| Structure |
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| Formula |
C31H30FN5O2
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| Molecular Weight |
523.612
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| Canonical SMILES |
Fc1ccccc1CN1C(=O)N(Cc2ccccc2)C(=O)C11CCN(Cc2ccc(cc2)-n2ccnc2)CC1
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| InChI |
InChI=1S/C31H30FN5O2/c32-28-9-5-4-8-26(28)22-37-30(39)36(21-24-6-2-1-3-7-24)29(38)31(37)14-17-34(18-15-31)20-25-10-12-27(13-11-25)35-19-16-33-23-35/h1-13,16,19,23H,14-15,17-18,20-22H2
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| InChIKey |
ODLRYYFKCKZBFP-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