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Compound Detail

CHEMBL1187163

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COc1ccc2c(c1OC)[C@]13CCC(=O)[C@]4(O)O[C@H]2C[C@]14N(C)CC3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187163
Phase Preclinical
Structure Type MOL
InChI Key VGXWMITWMBIILG-PZGXJPJSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

345.4
MW (Da)
1.54
ALogP
6
HBA
1
HBD
68.2
PSA (Ų)
0.88
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C19H23NO5
MW 345.40
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness 2.63

Data from ChEMBL 36 via Core Engine