General Information of the Compound
| Compound ID |
CP0270411
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| Compound Name |
4-Amino-piperidine-4-carboxylic acid [1-[(R)-(R)-1-formylamino-2-(1H-indol-3-yl)-ethylcarbamoyl]-2-(1H-indol-3-yl)-ethyl]-amide
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| Structure |
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| Formula |
C28H33N7O3
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| Molecular Weight |
515.618
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| Canonical SMILES |
NC1(CCNCC1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1c[nH]c2ccccc12)NC=O
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| InChI |
InChI=1S/C28H33N7O3/c29-28(9-11-30-12-10-28)27(38)34-24(13-18-15-31-22-7-3-1-5-20(18)22)26(37)35-25(33-17-36)14-19-16-32-23-8-4-2-6-21(19)23/h1-8,15-17,24-25,30-32H,9-14,29H2,(H,33,36)(H,34,38)(H,35,37)/t24-,25-/m1/s1
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| InChIKey |
PFJXRSKIAGAAGG-JWQCQUIFSA-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