General Information of the Compound
| Compound ID |
CP0418062
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| Compound Name |
methyl (2S)-2-amino-5-[(N'-methylcarbamimidoyl)amino]pentanoate
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| Structure |
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| Formula |
C8H18N4O2
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| Molecular Weight |
202.258
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| Canonical SMILES |
COC(=O)[C@@H](N)CCCNC(N)=NC
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| InChI |
InChI=1S/C8H18N4O2/c1-11-8(10)12-5-3-4-6(9)7(13)14-2/h6H,3-5,9H2,1-2H3,(H3,10,11,12)/t6-/m0/s1
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| InChIKey |
QSCWCVPGABUFIS-LURJTMIESA-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
Protein ID: PT01406, Nitric oxide synthase 1
Protein ID: PT01856, Nitric oxide synthase 3
Protein ID: PT01472, Nitric oxide synthase, inducible