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Compound Detail

CHEMBL4803414

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CC1(C)N=C(N)N=C(N)N1OCCCOc1ccc(F)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803414
Phase Preclinical
Structure Type MOL
InChI Key LWMCHYYYRYHTJY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

343.8
MW (Da)
1.86
ALogP
7
HBA
2
HBD
98.5
PSA (Ų)
0.77
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H19ClFN5O2
MW 343.79
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.78

Data from ChEMBL 36 via Core Engine