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Compound Detail

CHEMBL4803506

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CC1(C)N=C(N)N=C(N)N1OCCCOCc1ccccc1

Basic Information

ChEMBL ID CHEMBL4803506
Phase Preclinical
Structure Type MOL
InChI Key NNABZQZXYWRNMS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

305.4
MW (Da)
1.21
ALogP
7
HBA
2
HBD
98.5
PSA (Ų)
0.74
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H23N5O2
MW 305.38
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -0.19

Data from ChEMBL 36 via Core Engine