Chemical ID: 7625016

CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)NC(CC(C(=O)O)F)C(=O)O
Chemical ID:
7625016
Name [?]:
2-[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino-4-fluoro-pentanedioic acid
SMILES [?]:
CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)NC(CC(C(=O)O)F)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H21FN8O5
All Atoms:55
Heavy Atoms:34
Chiral Atoms:None
ZAP Information [?]
Total:10.3669
Area:706.157
Solvation:-7.28701
Coulombic:-140.027
Bond Count [?]
All:36
Single:25
Double:11
Rotors:10
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:0.12
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue