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Compound Detail

CHEMBL2078844

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CC(C)CNCCO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2078844
Phase Preclinical
Structure Type MOL
InChI Key IDDGFISGHBHSPG-RCQQOWRMSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

383.5
MW (Da)
3.46
ALogP
6
HBA
1
HBD
58.2
PSA (Ų)
0.56
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H37NO5
MW 383.53
Aromatic Rings 0
Heavy Atoms 27
NP-Likeness 2.77

Data from ChEMBL 36 via Core Engine