(E)-3-(furan-2-yl)-N-[4-[6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-1H-benzimidazol-2-yl]phenyl]prop-2-enamide

Formula:C27H20N4O4 Mutagenic:high Tumorigenic:none Reproductive Effective:none (E)-3-(furan-2-yl)-N-[4-[6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-1H-benzimidazol-2-yl]phenyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(furan-2-yl)-N-[4-[6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-1H-benzimidazol-2-yl]phenyl]prop-2-enamide
MolecularFormula	C27H20N4O4
Smiles	O=C(/C=C/c1ccco1)Nc(cc1)ccc1-c1nc(ccc(NC(/C=C/c2ccco2)=O)c2)c2[nH]1
InChI	InChI=1S/C27H20N4O4/c32-25(13-10-21-3-1-15-34-21)28-19-7-5-18(6-8-19)27-30-23-12-9-20(17-24(23)31-27)29-26(33)14-11-22-4-2-16-35-22/h1-17H,(H,28,32)(H,29,33)(H,30,31)
InChIK	UVFVGMMQAMBWJB-UHFFFAOYSA-N
TotalMolweight	464.48
Molweight	464.48
MonoisotopicMass	464.148456
CLogP	4.233
CLogS	-7.1
H Acceptors	8
H Donors	3
TotalSurfaceArea	366.27
Relative PSA	0.27897
PolarSurfaceArea	113.16
Druglikeness	0.021318
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.65714
Fragments	1
Non HAtoms	35
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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1 - (E)-3-(furan-2-yl)-N-[4-[6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-1H-benzimidazol-2-yl]phenyl]prop-2-enamide | 2 - (E)-3-(furan-2-yl)-N-[4-[6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-1H-benzimidazol-2-yl]phenyl]prop-2-enamide

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