3-hydroxy-1-(naphthalen-1-ylmethyl)-3-[(Z)-2-oxo-4-phenylbut-3-enyl]indol-2-one

Formula:C29H23NO3 Mutagenic:none Tumorigenic:high Reproductive Effective:none 3-hydroxy-1-(naphthalen-1-ylmethyl)-3-[(Z)-2-oxo-4-phenylbut-3-enyl]indol-2-one is not a drug-like molecule.

MolName	3-hydroxy-1-(naphthalen-1-ylmethyl)-3-[(Z)-2-oxo-4-phenylbut-3-enyl]indol-2-one
MolecularFormula	C29H23NO3
Smiles	OC(CC(/C=C\c1ccccc1)=O)(c(cccc1)c1N1Cc2cccc3ccccc23)C1=O
InChI	InChI=1S/C29H23NO3/c31-24(18-17-21-9-2-1-3-10-21)19-29(33)26-15-6-7-16-27(26)30(28(29)32)20-23-13-8-12-22-11-4-5-14-25(22)23/h1-18,33H,19-20H2/t29-/m0/s1
InChIK	FQTBATMWPPXGOH-LJAQVGFWSA-N
TotalMolweight	433.506
Molweight	433.506
MonoisotopicMass	433.167794
CLogP	5.0351
CLogS	-6.51
H Acceptors	4
H Donors	1
TotalSurfaceArea	330.46
Relative PSA	0.1293
PolarSurfaceArea	57.61
Druglikeness	5.3068
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	4
Electronegative Atoms	4
StereoCenters	1
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	4
Symmetricatoms	2
Amides	1
StereoCon	racemate

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