Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.18	8.79	-125.48	5	11	-2	193	493.501	9	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	-0.18	6.77	-69.36	6	11	-1	190	494.509	9	↓ MOL2 SDF SMILES Flexibase

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
DRTS-1-E	Bifunctional Dihydrofolate Reductase-thymidylate Synthase (cluster #1 Of 3), Eukaryotic	Eukaryotes	20	0.31	Binding ≤ 10μM
DYR-1-E	Dihydrofolate Reductase (cluster #1 Of 3), Eukaryotic	Eukaryotes	90	0.28	Binding ≤ 10μM
TYSY-1-E	Thymidylate Synthase (cluster #1 Of 3), Eukaryotic	Eukaryotes	68	0.29	Binding ≤ 10μM
E2QDN0-1-B	Thymidylate Synthase (EC 2.1.1.45) (TS) (TSase) (cluster #1 Of 1), Bacterial	Bacteria	17	0.31	Binding ≤ 10μM

ChEMBL Target Annotations
Uniprot	Swissprot	Description	Affinity (nM)	LE (kcal/mol/atom)	Type
DRTS_TOXGO	Q07422	Dihydrofolate Reductase, Toxgo	140	0.27	Binding ≤ 1μM
DYR_HUMAN	P00374	Dihydrofolate Reductase, Human	90	0.28	Binding ≤ 1μM
TYSY_HUMAN	P04818	Thymidylate Synthase, Human	68	0.29	Binding ≤ 1μM
E2QDN0_ECOLX	E2QDN0	Thymidylate Synthase (EC 2.1.1.45) (TS) (TSase), Ecolx	17	0.31	Binding ≤ 1μM
DRTS_TOXGO	Q07422	Dihydrofolate Reductase, Toxgo	140	0.27	Binding ≤ 10μM
DYR_HUMAN	P00374	Dihydrofolate Reductase, Human	90	0.28	Binding ≤ 10μM
TYSY_HUMAN	P04818	Thymidylate Synthase, Human	68	0.29	Binding ≤ 10μM
E2QDN0_ECOLX	E2QDN0	Thymidylate Synthase (EC 2.1.1.45) (TS) (TSase), Ecolx	17	0.31	Binding ≤ 10μM

Description	Species
E2F mediated regulation of DNA replication	Homo sapiens (DYR_HUMAN)
G1/S-Specific Transcription	Homo sapiens (DYR_HUMAN)
Metabolism of folate and pterines	Homo sapiens (DYR_HUMAN)
Pyrimidine biosynthesis	Homo sapiens (TYSY_HUMAN)
Tetrahydrobiopterin (BH4) synthesis, recycling, salvage and regulation	Homo sapiens (DYR_HUMAN)