Chemical ID: 4260508

Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)O
Chemical ID:
4260508
Name [?]:
2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-thiazol-5-yl]ethoxyphosphonic acid
SMILES [?]:
Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H18N4O4PS+
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:-18.4629
Area:538.807
Solvation:-31.933
Coulombic:-53.2414
Bond Count [?]
All:23
Single:17
Double:6
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:345.336
H-Bond Donors:4
H-Bond Acceptors:5
XLogP:-0.46
LogP (Chemaxon):-7.14

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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