2-[(Z)-1-[2-oxo-4-[(E)-2-phenylethenyl]chromen-7-yl]oxy-2-phenylethenyl]-3,1-benzoxazin-4-one

Formula:C33H21NO5 Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-[(Z)-1-[2-oxo-4-[(E)-2-phenylethenyl]chromen-7-yl]oxy-2-phenylethenyl]-3,1-benzoxazin-4-one is not a drug-like molecule.

MolName	2-[(Z)-1-[2-oxo-4-[(E)-2-phenylethenyl]chromen-7-yl]oxy-2-phenylethenyl]-3,1-benzoxazin-4-one
MolecularFormula	C33H21NO5
Smiles	O=C1Oc(cc(cc2)O/C(/C(O3)=Nc(cccc4)c4C3=O)=C\c3ccccc3)c2C(/C=C/c2ccccc2)=C1
InChI	InChI=1S/C33H21NO5/c35-31-20-24(16-15-22-9-3-1-4-10-22)26-18-17-25(21-29(26)38-31)37-30(19-23-11-5-2-6-12-23)32-34-28-14-8-7-13-27(28)33(36)39-32/h1-21H
InChIK	YTULQCIFFQVHLB-UHFFFAOYSA-N
TotalMolweight	511.532
Molweight	511.532
MonoisotopicMass	511.141974
CLogP	6.1732
CLogS	-7.122
H Acceptors	6
TotalSurfaceArea	389.93
Relative PSA	0.17334
PolarSurfaceArea	74.19
Druglikeness	-2.0535
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.48718
Fragments	1
Non HAtoms	39
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	6
Small Rings	6
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	3
Symmetricatoms	4
StereoCon

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1 - 2-[(Z)-1-[2-oxo-4-[(E)-2-phenylethenyl]chromen-7-yl]oxy-2-phenylethenyl]-3,1-benzoxazin-4-one | 2 - 2-[(Z)-1-[2-oxo-4-[(E)-2-phenylethenyl]chromen-7-yl]oxy-2-phenylethenyl]-3,1-benzoxazin-4-one

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