General Information of the Compound
| Compound ID |
CP0953887
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| Compound Name |
N-(1H-Indazol-5-yl)-2-(piperidin-1-ylmethyl)biphenyl-4-carboxamide dihydrochloride
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| Structure |
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| Formula |
C26H28Cl2N4O
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| Molecular Weight |
483.443
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| Canonical SMILES |
Cl.Cl.O=C(Nc1ccc2[nH]ncc2c1)c1ccc(-c2ccccc2)c(CN2CCCCC2)c1
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| InChI |
InChI=1S/C26H26N4O.2ClH/c31-26(28-23-10-12-25-21(16-23)17-27-29-25)20-9-11-24(19-7-3-1-4-8-19)22(15-20)18-30-13-5-2-6-14-30;;/h1,3-4,7-12,15-17H,2,5-6,13-14,18H2,(H,27,29)(H,28,31);2*1H
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| InChIKey |
IMNINDUDZZZGAO-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