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Compound Detail

CHEMBL6070227

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Cc1c(Nc2nccc3cc(CN4CC[C@@H](O)C4)cnc23)cccc1-c1cccc(-c2nc3ccc(CN4CC[C@@H](C(=O)O)C4)c(C#N)c3o2)c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6070227
Phase Preclinical
Structure Type MOL
InChI Key OIOYLCFBXSVPBL-LOYHVIPDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

693.8
MW (Da)
6.81
ALogP
10
HBA
3
HBD
151.6
PSA (Ų)
0.15
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C41H39N7O4
MW 693.81
Aromatic Rings 6
Heavy Atoms 52
NP-Likeness -0.93

Data from ChEMBL 36 via Core Engine