General Information of the Compound
| Compound ID |
CP0551486
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| Compound Name |
N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylpropan-2-yl]acetamide
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| Structure |
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| Formula |
C24H22FN3O2
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| Molecular Weight |
403.457
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| Canonical SMILES |
C[C@H](NC(C)=O)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccccc1
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| InChI |
InChI=1S/C24H22FN3O2/c1-16(27-17(2)29)24(18-6-4-3-5-7-18)30-22-12-13-23-19(14-22)15-26-28(23)21-10-8-20(25)9-11-21/h3-16,24H,1-2H3,(H,27,29)/t16-,24-/m0/s1
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| InChIKey |
PBDVQJSHALGZGV-FYSMJZIKSA-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