Chemical ID: 5171896

c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=Nc3c(nc(nc3O)N)NC2
Chemical ID:
5171896
Name [?]:
2-[4-[(2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methylamino]benzoyl]aminopentanedioic acid
SMILES [?]:
c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=Nc3c(nc(nc3O)N)NC2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H21N7O6
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:10.6199
Area:695.532
Solvation:-6.76838
Coulombic:-146.263
Bond Count [?]
All:34
Single:24
Double:10
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:443.414
H-Bond Donors:8
H-Bond Acceptors:11
XLogP:-0.46
LogP (Chemaxon):-1.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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