[4-[(Z)-[[(E)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]hydrazinylidene]methyl]phenyl] (E)-3-(furan-2-yl)prop-2-enoate

Formula:C28H21N3O5S Mutagenic:high Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[(E)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]hydrazinylidene]methyl]phenyl] (E)-3-(furan-2-yl)prop-2-enoate is not a drug-like molecule.

MolName	[4-[(Z)-[[(E)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]hydrazinylidene]methyl]phenyl] (E)-3-(furan-2-yl)prop-2-enoate
MolecularFormula	C28H21N3O5S
Smiles	O=C(/C=C/c1ccco1)Oc1ccc(/C=N\NC(/C(/NC(c2ccccc2)=O)=C\c2cccs2)=O)cc1
InChI	InChI=1S/C28H21N3O5S/c32-26(15-14-22-8-4-16-35-22)36-23-12-10-20(11-13-23)19-29-31-28(34)25(18-24-9-5-17-37-24)30-27(33)21-6-2-1-3-7-21/h1-19H,(H,30,33)(H,31,34)
InChIK	LRYJMHKNAKUVLE-UHFFFAOYSA-N
TotalMolweight	511.557
Molweight	511.557
MonoisotopicMass	511.120192
CLogP	5.6333
CLogS	-6.998
H Acceptors	8
H Donors	2
TotalSurfaceArea	400.31
Relative PSA	0.29482
PolarSurfaceArea	138.24
Druglikeness	4.851
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.59459
Fragments	1
Non HAtoms	37
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	10
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	1
Symmetricatoms	4
Amides	1
StereoCon

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1 - [4-[(Z)-[[(E)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]hydrazinylidene]methyl]phenyl] (E)-3-(furan-2-yl)prop-2-enoate | 2 - [4-[(Z)-[[(E)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]hydrazinylidene]methyl]phenyl] (E)-3-(furan-2-yl)prop-2-enoate

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