Chemical ID: 3965001

c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CSCCN)O)O)N
Chemical ID:
3965001
Name [?]:
2-(2-aminoethylsulfanylmethyl)-5-(6-aminopurin-9-yl)-tetrahydrofuran-3,4-diol
SMILES [?]:
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CSCCN)O)O)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H18N6O3S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:4
ZAP Information [?]
Total:7.46962
Area:520.92
Solvation:-5.55338
Coulombic:-94.8977
Bond Count [?]
All:24
Single:20
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:326.376
H-Bond Donors:6
H-Bond Acceptors:5
XLogP:-0.94
LogP (Chemaxon):-1.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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