General Information of the Compound
| Compound ID |
CP0531746
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| Compound Name |
(1R,3R)-N-(diaminomethylidene)-3-(3-methoxyphenyl)-2,2-dimethylcyclopropane-1-carboxamide
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| Structure |
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| Formula |
C14H19N3O2
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| Molecular Weight |
261.325
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| Canonical SMILES |
COc1cccc(c1)[C@@H]1[C@@H](C(=O)NC(N)=N)C1(C)C
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| InChI |
InChI=1S/C14H19N3O2/c1-14(2)10(11(14)12(18)17-13(15)16)8-5-4-6-9(7-8)19-3/h4-7,10-11H,1-3H3,(H4,15,16,17,18)/t10-,11+/m1/s1
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| InChIKey |
UFVSKVNXAJRTMK-MNOVXSKESA-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