AC1L7HC7

2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid

Also Known As: 2-[[4-[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methylsulfanyl]benzoyl]amino]pentanedioic acid|L-Glutamic acid,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methyl]thio]benzoyl]-|L-Glutamic acid, N-[4-[[(2,4-diaminopyrido[3, 2-d]pyrimidin-6-yl)methyl]thio]benzoyl]-|N-(4-{[(2,4-Diaminopyrido[3,2-d]pyrimidin-6-yl)methyl]sulfanyl}benzoyl)glutamic acid

Molecular Formula	C20H20N6O5S
Molecular Weight	456.12158 g/mol
LogP	0.7
Topological Polar Surface Area	220.0 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	11
Rotatable Bonds	9
Exact Mass	456.12158
Monoisotopic Mass	456.12158
Heavy Atoms	32
Complexity	677.0

Chemical Identifiers

CAS Number	76822-63-4
SMILES	C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)SCC2=NC3=C(C=C2)N=C(N=C3N)N
InChIKey	LKSYAPXCVZORHU-UHFFFAOYSA-N