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Compound Detail

CHEMBL1189497

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CCCCn1c(=O)c(NC(=O)Nc2c(C(C)C)ccc(N)c2C(C)C)c(-c2cccc(OCCCO)c2)c2cccnc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189497
Phase Preclinical
Structure Type MOL
InChI Key XHSSXDFKUUDOFX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

585.8
MW (Da)
7.10
ALogP
7
HBA
4
HBD
131.5
PSA (Ų)
0.10
QED
2
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H43N5O4
MW 585.75
Aromatic Rings 4
Heavy Atoms 43
NP-Likeness -0.61

Data from ChEMBL 36 via Core Engine