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Compound Detail

CHEMBL5781679

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Cc1cc(C(=O)N2CCC(c3cn([C@H]4CC[C@H](O)CC4)c4nc(NCCCCO)ncc34)CC2)cc(C)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5781679
Phase Preclinical
Structure Type MOL
InChI Key VPRQPPWLEAVEAI-RQNOJGIXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

520.7
MW (Da)
4.12
ALogP
8
HBA
3
HBD
116.4
PSA (Ų)
0.38
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H40N6O3
MW 520.68
Aromatic Rings 3
Heavy Atoms 38
NP-Likeness -0.72

Data from ChEMBL 36 via Core Engine