Identifier: MM173225

2D Structure
3D Structure
Source:
General
Identifier MM173225
SMILES C=CC(C)C(=C)CCF
InChIKey KVAYDTZBPQCWHF-UHFFFAOYSA-N
MW [Da] 128.19

Automatically obtained from RDkit software.

LogP 2.72

Automatically obtained from RDkit software.

Links

PubChem

N/A

DrugBank

N/A

ChEBI

N/A

PDB

N/A

ChEMBL

N/A

No data

Methods

Computed
QSAR
Simulated
Coarse grain MD

No data

No transporter data found.