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Compound Detail

CHEMBL1198102

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CN(C)c1cc2c(cc1O)CC[C@@H]1[C@@H]2CC[C@]2(C)CCC[C@@H]12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1198102
Phase Preclinical
Structure Type MOL
InChI Key DVHFSMRWWOQJII-MQJTVSLUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

299.5
MW (Da)
4.70
ALogP
2
HBA
1
HBD
23.5
PSA (Ų)
0.81
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H29NO
MW 299.46
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness 1.59

Data from ChEMBL 36 via Core Engine