General Information of the Compound
| Compound ID |
CP0466673
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| Compound Name |
MLS000860929
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| Structure |
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| Formula |
C20H24ClN3O
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| Molecular Weight |
357.885
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| Canonical SMILES |
Clc1ccc2c(ccnc2c1)N1CCN(CC1)C(=O)C1CCCCC1
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| InChI |
InChI=1S/C20H24ClN3O/c21-16-6-7-17-18(14-16)22-9-8-19(17)23-10-12-24(13-11-23)20(25)15-4-2-1-3-5-15/h6-9,14-15H,1-5,10-13H2
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| InChIKey |
NWPLPOACXICHEB-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
Protein ID: PT06109, Geminin
Protein ID: PT06101, Latent membrane protein 1