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Compound Detail

CHEMBL1190201

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CC(=O)Nc1cccc([C@@H](CN2CC[C@H](O)C2)N(C)C(=O)C(c2ccccc2)c2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1190201
Phase Preclinical
Structure Type MOL
InChI Key HNNRHYCRMKQZLP-RRPNLBNLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

471.6
MW (Da)
4.04
ALogP
4
HBA
2
HBD
72.9
PSA (Ų)
0.52
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H33N3O3
MW 471.60
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -0.89

Data from ChEMBL 36 via Core Engine