Identifier: MM292736

2D Structure
3D Structure
Source:
General
Identifier MM292736
SMILES CC(CC#N)C(C)OC=O
InChIKey KFIWJIVSOPSYRS-UHFFFAOYSA-N
MW [Da] 141.17

Automatically obtained from RDkit software.

LogP 1.1

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.