cyanomethyl 3-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzoate

Formula:C23H14N4O3 Mutagenic:high Tumorigenic:high Reproductive Effective:high cyanomethyl 3-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzoate is a drug-like molecule.

MolName	cyanomethyl 3-[5-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzoate
MolecularFormula	C23H14N4O3
Smiles	N#CCOC(c1cc(-c2ccc(/C=C(\c3nc(cccc4)c4[nH]3)/C#N)o2)ccc1)=O
InChI	InChI=1S/C23H14N4O3/c24-10-11-29-23(28)16-5-3-4-15(12-16)21-9-8-18(30-21)13-17(14-25)22-26-19-6-1-2-7-20(19)27-22/h1-9,12-13H,11H2,(H,26,27)
InChIK	DWEOIXLCVIPXEN-UHFFFAOYSA-N
TotalMolweight	394.389
Molweight	394.389
MonoisotopicMass	394.106591
CLogP	3.3255
CLogS	-5.173
H Acceptors	7
H Donors	1
TotalSurfaceArea	315.04
Relative PSA	0.28323
PolarSurfaceArea	115.7
Druglikeness	-2.5455
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	2
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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