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Compound Detail

CHEMBL4117115

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Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1NC(=O)CN1CCNCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4117115
Phase Preclinical
Structure Type MOL
InChI Key QYNYPYGXHSJLHB-YBEGLDIGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

397.4
MW (Da)
2.11
ALogP
4
HBA
4
HBD
89.3
PSA (Ų)
0.60
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H24FN5O2
MW 397.45
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -1.26

Data from ChEMBL 36 via Core Engine