General Information of the Compound
| Compound ID |
CP0454761
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| Compound Name |
5-[5-(4-piperidin-1-ylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1,3-dihydroindol-2-one
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| Structure |
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| Formula |
C20H25N5OS
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| Molecular Weight |
383.521
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| Canonical SMILES |
O=C1Cc2cc(ccc2N1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
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| InChI |
InChI=1S/C20H25N5OS/c26-18-13-15-12-14(4-5-17(15)21-18)19-22-23-20(27-19)25-10-6-16(7-11-25)24-8-2-1-3-9-24/h4-5,12,16H,1-3,6-11,13H2,(H,21,26)
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| InChIKey |
OVRVPUNPWUSLMQ-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