General Information of the Compound
| Compound ID |
CP0576578
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| Compound Name |
N-[4-[4-[(2S)-2-amino-4-methylpentoxy]phenyl]pyridin-2-yl]acetamide
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| Structure |
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| Formula |
C19H25N3O2
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| Molecular Weight |
327.428
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| Canonical SMILES |
CC(C)C[C@H](N)COc1ccc(cc1)-c1ccnc(NC(C)=O)c1
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| InChI |
InChI=1S/C19H25N3O2/c1-13(2)10-17(20)12-24-18-6-4-15(5-7-18)16-8-9-21-19(11-16)22-14(3)23/h4-9,11,13,17H,10,12,20H2,1-3H3,(H,21,22,23)/t17-/m0/s1
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| InChIKey |
NTUDYGKBBUSAQU-KRWDZBQOSA-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