N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide

Formula:C22H17N2O5Br Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide is a drug-like molecule.

MolName	N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
MolecularFormula	C22H17N2O5Br
Smiles	O=C(/C(/NC(c(cc1)ccc1Br)=O)=C/c(cc1)cc2c1OCO2)NCc1ccco1
InChI	InChI=1S/C22H17BrN2O5/c23-16-6-4-15(5-7-16)21(26)25-18(22(27)24-12-17-2-1-9-28-17)10-14-3-8-19-20(11-14)30-13-29-19/h1-11H,12-13H2,(H,24,27)(H,25,26)
InChIK	JSWOCPQBNJCDSJ-UHFFFAOYSA-N
TotalMolweight	469.29
Molweight	469.29
MonoisotopicMass	468.032084
CLogP	4.1585
CLogS	-5.916
H Acceptors	7
H Donors	2
TotalSurfaceArea	318.25
Relative PSA	0.26115
PolarSurfaceArea	89.8
Druglikeness	1.322
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.46667
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	4
Symmetricatoms	2
Amides	2
StereoCon

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