General Information of the Compound
| Compound ID |
CP0411289
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| Compound Name |
CHEMBL3394407
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| Formula |
C24H34N4O3
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| Molecular Weight |
426.561
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| Canonical SMILES |
NC(=O)CCC1CCN(CC1)c1cccc(n1)C(=O)N[C@H]1C2CC3CC1C[C@](O)(C3)C2
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| InChI |
InChI=1S/C24H34N4O3/c25-20(29)5-4-15-6-8-28(9-7-15)21-3-1-2-19(26-21)23(30)27-22-17-10-16-11-18(22)14-24(31,12-16)13-17/h1-3,15-18,22,31H,4-14H2,(H2,25,29)(H,27,30)/t16?,17?,18?,22-,24-
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| InChIKey |
ROHLMJDNOQMLQP-IQEKICRDSA-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