Tapinarof
5-[(E)-2-phenylethenyl]-2-propan-2-ylbenzene-1,3-diol
Molecular Identity
Tapinarof
5-[(E)-2-phenylethenyl]-2-propan-2-ylbenzene-1,3-diol
PubChem CID: 6439522
2D Structure
Properties
C17H18O2
Molecular Formula
254.32
Molecular Weight
g/mol
254.1307
Exact Mass
Da
4.6
XLogP
Drug-like (Lipinski: < 5)
40.5
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
2
H-Bond Acceptors
280
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)C1=C(C=C(C=C1O)C=CC2=CC=CC=C2)OIsomeric SMILES
SMILES: CC(C)C1=C(C=C(C=C1O)/C=C/C2=CC=CC=C2)OSynonyms(20)
BenvitimodTapinarof79338-84-43,5-Dihydroxy-4-isopropylstilbeneVtamaWBI-1001GSK2894512GSK-28945123,5-dihydroxy-4-isopropyl-trans-stilbene5-[(E)-2-phenylethenyl]-2-propan-2-ylbenzene-1,3-diol3,5-DH4ISWBI 1001(E)-2-(1-Methylethyl)-5-(2-phenylethenyl)-1,3-benzenediol84HW7D0V04DTXSID301045262
Data from PubChem (NCBI)
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Drug Network
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