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Compound Detail

CHEMBL4597780

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N=C(N)N1CCC(C(NCCC2CCNCC2)P(=O)(Oc2ccccc2)Oc2ccccc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597780
Phase Preclinical
Structure Type MOL
InChI Key WFUSPPABIKEVRT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

499.6
MW (Da)
4.25
ALogP
6
HBA
4
HBD
112.7
PSA (Ų)
0.22
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H38N5O3P
MW 499.60
Aromatic Rings 2
Heavy Atoms 35
NP-Likeness -0.15

Data from ChEMBL 36 via Core Engine