General Information of the Compound
| Compound ID |
CP0297077
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| Compound Name |
(2S)-1-[3-[4-[[(2S)-2-(cyclopropylsulfonylamino)propyl]amino]-6-methylindazol-1-yl]benzoyl]pyrrolidine-2-carboxamide
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| Structure |
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| Formula |
C26H32N6O4S
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| Molecular Weight |
524.647
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| Canonical SMILES |
C[C@@H](CNc1cc(C)cc2n(ncc12)-c1cccc(c1)C(=O)N1CCC[C@H]1C(N)=O)NS(=O)(=O)C1CC1
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| InChI |
InChI=1S/C26H32N6O4S/c1-16-11-22(28-14-17(2)30-37(35,36)20-8-9-20)21-15-29-32(24(21)12-16)19-6-3-5-18(13-19)26(34)31-10-4-7-23(31)25(27)33/h3,5-6,11-13,15,17,20,23,28,30H,4,7-10,14H2,1-2H3,(H2,27,33)/t17-,23-/m0/s1
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| InChIKey |
YDWRQVQUDJRKQZ-SBUREZEXSA-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