(E)-1-(2-hydroxyphenyl)-3-(2-phenyl-1H-indol-3-yl)prop-2-en-1-one

Formula:C23H17NO2 Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-1-(2-hydroxyphenyl)-3-(2-phenyl-1H-indol-3-yl)prop-2-en-1-one is a drug-like molecule.

MolName(E)-1-(2-hydroxyphenyl)-3-(2-phenyl-1H-indol-3-yl)prop-2-en-1-one
MolecularFormulaC23H17NO2
SmilesOc(cccc1)c1C(/C=C/c1c(-c2ccccc2)[nH]c2c1cccc2)=O
InChIInChI=1S/C23H17NO2/c25-21-13-7-5-11-19(21)22(26)15-14-18-17-10-4-6-12-20(17)24-23(18)16-8-2-1-3-9-16/h1-15,24-25H
InChIKGAEMJKLKHLMWKN-UHFFFAOYSA-N
TotalMolweight339.393
Molweight339.393
MonoisotopicMass339.125929
CLogP4.7477
CLogS-5.847
H Acceptors3
H Donors2
TotalSurfaceArea267.55
Relative PSA0.14999
PolarSurfaceArea53.09
Druglikeness1.516
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms26
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms21
Sp3Atoms1
Symmetricatoms2
Aromatic Nitrogens1
StereoCon

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