(4Z)-4-[hydroxy(phenyl)methylidene]-1-[2-(1H-indol-3-yl)ethyl]-5-pyridin-3-ylpyrrolidine-2,3-dione

Formula:C26H21N3O3 Mutagenic:high Tumorigenic:high Reproductive Effective:low (4Z)-4-[hydroxy(phenyl)methylidene]-1-[2-(1H-indol-3-yl)ethyl]-5-pyridin-3-ylpyrrolidine-2,3-dione is a drug-like molecule.

MolName	(4Z)-4-[hydroxy(phenyl)methylidene]-1-[2-(1H-indol-3-yl)ethyl]-5-pyridin-3-ylpyrrolidine-2,3-dione
MolecularFormula	C26H21N3O3
Smiles	O/C(/c1ccccc1)=C(/C(c1cnccc1)N(CCc1c[nH]c2c1cccc2)C1=O)\C1=O
InChI	InChI=1S/C26H21N3O3/c30-24(17-7-2-1-3-8-17)22-23(19-9-6-13-27-15-19)29(26(32)25(22)31)14-12-18-16-28-21-11-5-4-10-20(18)21/h1-11,13,15-16,23,28,30H,12,14H2/t23-/m0/s1
InChIK	NGYITGACQJHYPE-QHCPKHFHSA-N
TotalMolweight	423.471
Molweight	423.471
MonoisotopicMass	423.158292
CLogP	2.8258
CLogS	-3.313
H Acceptors	6
H Donors	2
TotalSurfaceArea	317.3
Relative PSA	0.21333
PolarSurfaceArea	86.29
Druglikeness	1.0601
Mutagenic	high
Tumorigenic	high
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.46875
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	4
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon	racemate

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