General Information of the Compound
| Compound ID |
CP0962610
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| Compound Name |
2-Amino-1-{5-[4-(morpholin-4-yl)phenyl]-1,3-dihydro-2H-isoindol-2-yl}ethanone hydrochloride
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| Structure |
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| Formula |
C20H24ClN3O2
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| Molecular Weight |
373.884
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| Canonical SMILES |
Cl.NCC(=O)N1Cc2ccc(-c3ccc(N4CCOCC4)cc3)cc2C1
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| InChI |
InChI=1S/C20H23N3O2.ClH/c21-12-20(24)23-13-17-2-1-16(11-18(17)14-23)15-3-5-19(6-4-15)22-7-9-25-10-8-22;/h1-6,11H,7-10,12-14,21H2;1H
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| InChIKey |
FIRAYQWOJIBGQS-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