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Compound Detail

CHEMBL1184174

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CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(N[C@H]4CC[C@H](N)CC4)nc32)[C@H](O)[C@@H]1O

Basic Information

ChEMBL ID CHEMBL1184174
Phase Preclinical
Structure Type MOL
InChI Key YIYNSYZLWNVLOK-FJUNXPAFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

600.7
MW (Da)
2.51
ALogP
11
HBA
6
HBD
172.5
PSA (Ų)
0.16
QED
3
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H40N8O4
MW 600.72
Aromatic Rings 4
Heavy Atoms 44
NP-Likeness -0.18

Data from ChEMBL 36 via Core Engine