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Compound Detail

CHEMBL1195883

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O=S(=O)(CCCCNc1c2ccccc2nc2ccccc12)c1ccc(N(CCCl)CCCl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195883
Phase Preclinical
Structure Type MOL
InChI Key UUPKCMSPWIDTDC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

530.5
MW (Da)
6.34
ALogP
5
HBA
1
HBD
62.3
PSA (Ų)
0.13
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 C27H29Cl2N3O2S
MW 530.52
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -1.03

Data from ChEMBL 36 via Core Engine