COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL029946
Chemical Name: 1-isothiocyanato-3-(propan-2-yloxy)propane
Smiles: S=C=NCCCOC(C)C

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Molecular Weight: 159.25
Empirical Formula: C7H13NOS

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 2.044
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 53
Number of rings: 0

     

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