N-[(E)-1-[5-(3-chlorophenyl)furan-2-yl]-3-(3-imidazol-1-ylpropylamino)-3-oxoprop-1-en-2-yl]benzamide

Formula:C26H23N4O3Cl Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(E)-1-[5-(3-chlorophenyl)furan-2-yl]-3-(3-imidazol-1-ylpropylamino)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(E)-1-[5-(3-chlorophenyl)furan-2-yl]-3-(3-imidazol-1-ylpropylamino)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C26H23N4O3Cl
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C\c1ccc(-c2cccc(Cl)c2)o1)NCCCn1cncc1
InChI	InChI=1S/C26H23ClN4O3/c27-21-9-4-8-20(16-21)24-11-10-22(34-24)17-23(30-25(32)19-6-2-1-3-7-19)26(33)29-12-5-14-31-15-13-28-18-31/h1-4,6-11,13,15-18H,5,12,14H2,(H,29,33)(H,30,32)
InChIK	VKOGNGMVEJKFJB-UHFFFAOYSA-N
TotalMolweight	474.947
Molweight	474.947
MonoisotopicMass	474.145868
CLogP	4.3521
CLogS	-5.247
H Acceptors	7
H Donors	2
TotalSurfaceArea	370.02
Relative PSA	0.21877
PolarSurfaceArea	89.16
Druglikeness	6.9582
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	34
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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