General Information of the Compound
| Compound ID |
CP0510733
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| Compound Name |
2-Diphenylacetylamino-5-guanidino-pentanoic acid (R)-indan-1-ylamide
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| Structure |
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| Formula |
C29H33N5O2
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| Molecular Weight |
483.616
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| Canonical SMILES |
NC(=N)NCCCC(NC(=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H]1CCc2ccccc12
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| InChI |
InChI=1S/C29H33N5O2/c30-29(31)32-19-9-16-25(27(35)33-24-18-17-20-10-7-8-15-23(20)24)34-28(36)26(21-11-3-1-4-12-21)22-13-5-2-6-14-22/h1-8,10-15,24-26H,9,16-19H2,(H,33,35)(H,34,36)(H4,30,31,32)/t24-,25?/m1/s1
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| InChIKey |
SEFXLRXUTBGZIN-IKOFQBKESA-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