(Z)-1-(1,4-dihydroxy-3-phenylnaphthalen-2-yl)-3-phenylprop-2-en-1-one

Formula:C25H18O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(1,4-dihydroxy-3-phenylnaphthalen-2-yl)-3-phenylprop-2-en-1-one is not a drug-like molecule.

MolName(Z)-1-(1,4-dihydroxy-3-phenylnaphthalen-2-yl)-3-phenylprop-2-en-1-one
MolecularFormulaC25H18O3
SmilesOc(c1ccccc11)c(C(/C=C\c2ccccc2)=O)c(-c2ccccc2)c1O
InChIInChI=1S/C25H18O3/c26-21(16-15-17-9-3-1-4-10-17)23-22(18-11-5-2-6-12-18)24(27)19-13-7-8-14-20(19)25(23)28/h1-16,27-28H
InChIKYTPSAJWJJVHZHP-UHFFFAOYSA-N
TotalMolweight366.415
Molweight366.415
MonoisotopicMass366.125595
CLogP5.466
CLogS-6.94
H Acceptors3
H Donors2
TotalSurfaceArea284.33
Relative PSA0.13801
PolarSurfaceArea57.53
Druglikeness0.13358
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.46429
Fragments1
Non HAtoms28
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms2
Symmetricatoms4
StereoCon

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