General Information of the Compound
| Compound ID |
CP0507957
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| Compound Name |
(R)-N-(4-hydroxybenzyl)-2-(2,2-diphenylacetamido)-5-(2-propylguanidino)pentanamide
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| Structure |
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| Formula |
C30H37N5O3
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| Molecular Weight |
515.658
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| Canonical SMILES |
CCCNC(N)=NCCC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)NCc1ccc(O)cc1
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| InChI |
InChI=1S/C30H37N5O3/c1-2-19-32-30(31)33-20-9-14-26(28(37)34-21-22-15-17-25(36)18-16-22)35-29(38)27(23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-8,10-13,15-18,26-27,36H,2,9,14,19-21H2,1H3,(H,34,37)(H,35,38)(H3,31,32,33)/t26-/m1/s1
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| InChIKey |
RETGFGKSPUBPBB-AREMUKBSSA-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