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Compound Detail

CHEMBL1789560

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CCN(CC)CCNc1cc(C)nc2c1ccc1c2ccc2c(NCCN(CC)CC)cc(C)nc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1789560
Phase Preclinical
Structure Type MOL
InChI Key YDXDIPBVWWLCOL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

486.7
MW (Da)
6.06
ALogP
6
HBA
2
HBD
56.3
PSA (Ų)
0.24
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H42N6
MW 486.71
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness -0.79

Data from ChEMBL 36 via Core Engine