General Information of the Compound
| Compound ID |
CP0500287
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| Compound Name |
2-[3-[2-chloro-5-(trifluoromethoxy)phenyl]-3-azaspiro[5.5]undecan-9-yl]ethanol
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| Structure |
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| Formula |
C19H25ClF3NO2
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| Molecular Weight |
391.861
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| Canonical SMILES |
OCCC1CCC2(CC1)CCN(CC2)c1cc(OC(F)(F)F)ccc1Cl
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| InChI |
InChI=1S/C19H25ClF3NO2/c20-16-2-1-15(26-19(21,22)23)13-17(16)24-10-8-18(9-11-24)6-3-14(4-7-18)5-12-25/h1-2,13-14,25H,3-12H2
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| InChIKey |
GTNYJWYYNOSATA-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