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Compound Detail

CHEMBL1194674

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Cc1ccc(C(C(=O)N(C)[C@H](CN2CC[C@H](O)C2)c2ccccc2)c2ccc(C)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194674
Phase Preclinical
Structure Type MOL
InChI Key BVYVQTZBCILICE-RRPNLBNLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

442.6
MW (Da)
4.70
ALogP
3
HBA
1
HBD
43.8
PSA (Ų)
0.58
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H34N2O2
MW 442.60
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -0.63

Data from ChEMBL 36 via Core Engine