Chemical ID: 3968761

c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCC2CNc3c(c(=O)nc([nH]3)N)N2
Chemical ID:
3968761
Name [?]:
2-[4-[(2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl)methylamino]benzoyl]aminopentanedioic acid
SMILES [?]:
c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCC2CNc3c(c(=O)nc([nH]3)N)N2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H23N7O6
All Atoms:32
Heavy Atoms:32
Chiral Atoms:2
ZAP Information [?]
Total:10.8111
Area:694.19
Solvation:-6.5436
Coulombic:-151.23
Bond Count [?]
All:34
Single:25
Double:9
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:445.43
H-Bond Donors:8
H-Bond Acceptors:11
XLogP:-0.16
LogP (Chemaxon):-3.03

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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