General Information of the Compound
| Compound ID |
CP0108605
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| Compound Name |
N-[(3S)-3-[1-(4-fluorophenyl)indazol-5-yl]-2,2-dimethyl-3-phenylpropyl]-2-phenylacetamide
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| Structure |
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| Formula |
C32H30FN3O
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| Molecular Weight |
491.61
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| Canonical SMILES |
CC(C)(CNC(=O)Cc1ccccc1)[C@@H](c1ccccc1)c1ccc2n(ncc2c1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C32H30FN3O/c1-32(2,22-34-30(37)19-23-9-5-3-6-10-23)31(24-11-7-4-8-12-24)25-13-18-29-26(20-25)21-35-36(29)28-16-14-27(33)15-17-28/h3-18,20-21,31H,19,22H2,1-2H3,(H,34,37)/t31-/m0/s1
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| InChIKey |
IKUATMHYCWRCHC-HKBQPEDESA-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