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Compound Detail

CHEMBL3306659

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C[n+]1cccc(/C=N/NC(=O)CC23CC4CC(CC(C4)C2)C3)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3306659
Phase Preclinical
Structure Type MOL
InChI Key KLIMHKWADVGJPJ-UDWIEESQSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

312.4
MW (Da)
2.57
ALogP
2
HBA
1
HBD
45.3
PSA (Ų)
0.52
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 C19H26N3O+
MW 312.44
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.69

Data from ChEMBL 36 via Core Engine