General Information of the Compound
| Compound ID |
CP0425328
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| Compound Name |
3-Chloro-4-hydroxy-benzoic acid [1-(4-trifluoromethoxy-benzyl)-1H-indol-5-ylmethylene]-hydrazide
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| Structure |
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| Formula |
C24H17ClF3N3O3
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| Molecular Weight |
487.865
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| Canonical SMILES |
Oc1ccc(cc1Cl)C(=O)N\N=C\c1ccc2n(Cc3ccc(OC(F)(F)F)cc3)ccc2c1
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| InChI |
InChI=1S/C24H17ClF3N3O3/c25-20-12-18(4-8-22(20)32)23(33)30-29-13-16-3-7-21-17(11-16)9-10-31(21)14-15-1-5-19(6-2-15)34-24(26,27)28/h1-13,32H,14H2,(H,30,33)/b29-13+
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| InChIKey |
SEOUCVXDVSSFGI-VFLNYLIXSA-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