Chemical ID: 3965793

c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCC2CNc3c(c(=O)nc([nH]3)N)N2C=O
Chemical ID:
3965793
Name [?]:
2-[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]aminopentanedioic acid
SMILES [?]:
c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCC2CNc3c(c(=O)nc([nH]3)N)N2C=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H23N7O7
All Atoms:34
Heavy Atoms:34
Chiral Atoms:2
ZAP Information [?]
Total:10.7739
Area:700.485
Solvation:-6.7382
Coulombic:-154.299
Bond Count [?]
All:36
Single:26
Double:10
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:473.44
H-Bond Donors:7
H-Bond Acceptors:12
XLogP:-0.65
LogP (Chemaxon):-2.59

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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