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Compound Detail

CHEMBL3039821

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CC(C)[C@H](C[C@H](O)[C@@H](N)CN1CC(=O)N(c2ccccc2Cl)CC1(C)C)C(=O)NCC(C)(C)CO

Basic Information

ChEMBL ID CHEMBL3039821
Phase Preclinical
Structure Type MOL
InChI Key WLAHFWWGPAVVEZ-VCOUNFBDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

511.1
MW (Da)
2.25
ALogP
6
HBA
4
HBD
119.1
PSA (Ų)
0.36
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H43ClN4O4
MW 511.11
Aromatic Rings 1
Heavy Atoms 35
NP-Likeness -0.22

Data from ChEMBL 36 via Core Engine