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Compound Detail

CHEMBL1090853

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Nc1cccc2c1C[C@@H](N1CCC(C(=O)N3CCCCC3)CC1)[C@H](O)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1090853
Phase Preclinical
Structure Type MOL
InChI Key WIKMJKNBZDRQLJ-WOJBJXKFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

357.5
MW (Da)
1.82
ALogP
4
HBA
2
HBD
69.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H31N3O2
MW 357.50
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -0.12

Data from ChEMBL 36 via Core Engine