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Compound Detail

CHEMBL4597036

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CCCCCCCCc1ccc(CO[C@H]2C[C@H](CO)N(C(=N)N)C2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597036
Phase Preclinical
Structure Type MOL
InChI Key WQRPNDMRRAULNV-UXHICEINSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

361.5
MW (Da)
3.43
ALogP
3
HBA
3
HBD
82.6
PSA (Ų)
0.32
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H35N3O2
MW 361.53
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness 0.31

Data from ChEMBL 36 via Core Engine