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Gefitinib


  • SKU Code: CH136940
Chemical Name - Gefitinib
Mol Weight - 446.909
Smiles - COc(cc(c1c2)ncnc1Nc(cc1)cc(Cl)c1F)c2OCCCN1CCOCC1
Property Name Property Value
Mol NameGefitinib
Molweight446.909
Monoisotopic Mass446.152096
Clogp3.9851
Clogs-5.062
H Acceptors7
H Donors1
Total Surface Area333.75
Relative Psa0.2006
Polar Surface Area68.74
Druglikeness0.47937
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.58065
Molecular Flexibility0.4222
Molecular Complexity0.85557
Fragments1
Non H Atoms31
Non Ch Atoms9
Electronegative Atoms9
Rotatable Bonds8
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms16
Sp3 Atoms12
Symmetric Atoms2
Amines1
Alkyl Amines1
Aromatic Nitrogens2
Basic Nitrogens1
SmilesCOc(cc(c1c2)ncnc1Nc(cc1)cc(Cl)c1F)c2OCCCN1CCOCC1
InChIC22H24N4O3ClF

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