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Compound Detail

CHEMBL3186610

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CC1CCCCN1c1cc(NC(=O)c2ccccc2)ncn1.O=CO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3186610
Phase Preclinical
Structure Type MOL
InChI Key AWXBMGDHMATBPZ-UHFFFAOYSA-N
Parent Compound CHEMBL3301873
Active Moiety CHEMBL3301873
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

296.4
MW (Da)
3.11
ALogP
4
HBA
1
HBD
58.1
PSA (Ų)
0.95
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H22N4O3
MW 342.40
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.47

Data from ChEMBL 36 via Core Engine