(E)-3-phenyl-1-(1,2,3,4-tetrahydrocarbazol-9-yl)prop-2-en-1-one

Formula:C21H19NO Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-phenyl-1-(1,2,3,4-tetrahydrocarbazol-9-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-phenyl-1-(1,2,3,4-tetrahydrocarbazol-9-yl)prop-2-en-1-one
MolecularFormula	C21H19NO
Smiles	O=C(/C=C/c1ccccc1)n1c(cccc2)c2c2c1CCCC2
InChI	InChI=1S/C21H19NO/c23-21(15-14-16-8-2-1-3-9-16)22-19-12-6-4-10-17(19)18-11-5-7-13-20(18)22/h1-4,6,8-10,12,14-15H,5,7,11,13H2
InChIK	LRVBKNXNOBFFEO-UHFFFAOYSA-N
TotalMolweight	301.388
Molweight	301.388
MonoisotopicMass	301.146664
CLogP	4.8448
CLogS	-4.88
H Acceptors	2
TotalSurfaceArea	242.61
Relative PSA	0.082066
PolarSurfaceArea	22
Druglikeness	-4.0075
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52174
Fragments	1
Non HAtoms	23
NonCHAtoms	2
Electronegative Atoms	2
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	4
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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