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Compound Detail

CHEMBL1193915

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CC(C)OC(=O)C1C2CC[C@H](C[C@@H]1OC(=O)c1ccccc1)N2C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193915
Phase Preclinical
Structure Type MOL
InChI Key NGJWCZYRIKMKEP-GYXIZQIFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

331.4
MW (Da)
2.65
ALogP
5
HBA
0
HBD
55.8
PSA (Ų)
0.79
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 C19H25NO4
MW 331.41
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness 0.67

Data from ChEMBL 36 via Core Engine