Chemical ID: 5703351

COc1cc(ccc1O)C=NN=c2[nH]c3c(ncnc3n2C4C(C(C(O4)CO)O)O)N
Chemical ID:
5703351
Name [?]:
2-[6-amino-8-[(4-hydroxy-3-methoxy-phenyl)methyleneaminoimino]-7H-purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
SMILES [?]:
COc1cc(ccc1O)C=NN=c2[nH]c3c(ncnc3n2C4C(C(C(O4)CO)O)O)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H21N7O6
All Atoms:31
Heavy Atoms:31
Chiral Atoms:4
ZAP Information [?]
Total:5.79991
Area:649.888
Solvation:-10.4473
Coulombic:-130.409
Bond Count [?]
All:34
Single:26
Double:8
Rotors:5
Chiral:2
Rigid Segments:6
Chemical Properties
Molecular Weight:431.403
H-Bond Donors:6
H-Bond Acceptors:9
XLogP:1.32
LogP (Chemaxon):0.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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