General Information of the Compound
| Compound ID |
CP0408408
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| Compound Name |
benzyl N-[(2S)-1-(5-aminopentylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
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| Structure |
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| Formula |
C24H30N4O3
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| Molecular Weight |
422.529
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| Canonical SMILES |
NCCCCCNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1
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| InChI |
InChI=1S/C24H30N4O3/c25-13-7-2-8-14-26-23(29)22(15-19-16-27-21-12-6-5-11-20(19)21)28-24(30)31-17-18-9-3-1-4-10-18/h1,3-6,9-12,16,22,27H,2,7-8,13-15,17,25H2,(H,26,29)(H,28,30)/t22-/m0/s1
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| InChIKey |
ULROJUVPZZTQRJ-QFIPXVFZSA-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