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Chem Cupferron Molychem | Cheminformatics

Cupferron


  • SKU Code: CH141021
Chemical Name - Cupferron
Mol Weight - 138.126
Smiles - ON(c1ccccc1)N=O.N
Property Name Property Value
Mol NameCupferron
Molweight138.126
Monoisotopic Mass138.042928
Clogp1.7566
Clogs-2.107
H Acceptors4
H Donors1
Total Surface Area107.71
Relative Psa0.38251
Polar Surface Area52.9
Druglikeness-1.3453
Mutagenichigh
Tumorigenichigh
Reproductive Effectivelow
Irritanthigh
Shape Index0.7
Molecular Flexibility0.4753
Molecular Complexity0.55452
Fragments2
Non H Atoms10
Non Ch Atoms4
Electronegative Atoms4
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms1
Symmetric Atoms2
SmilesON(c1ccccc1)N=O.N
InChIKeyInChI=1S/C6H6N2O2.H3N/c9-7-8(10)6-4-2-1-3-5-6;/h1-5,10H;1H3
InChINJVHCUNZAMFQNA-UHFFFAOYSA-N

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1 - Cupferron
2 - Cupferron
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