COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL012113
Chemical Name: (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoicacid
Smiles: OC(=O)/C=C/c1ccc(c(c1)O)O

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Molecular Weight: 180.16
Empirical Formula: C9H8O4

Physical State: Dry powder
Available Amount: 1129 mg

Lipinsky:
logP: 1.424
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 77
Number of rings: 1

     

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