4-[5-[(Z)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzenesulfonamide

Formula:C20H13N3O3S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-[5-[(Z)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzenesulfonamide is a drug-like molecule.

MolName	4-[5-[(Z)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzenesulfonamide
MolecularFormula	C20H13N3O3S2
Smiles	NS(c(cc1)ccc1-c1ccc(/C=C(\c2nc(cccc3)c3s2)/C#N)o1)(=O)=O
InChI	InChI=1S/C20H13N3O3S2/c21-12-14(20-23-17-3-1-2-4-19(17)27-20)11-15-7-10-18(26-15)13-5-8-16(9-6-13)28(22,24)25/h1-11H,(H2,22,24,25)
InChIK	FIFSWXQWAAINEY-UHFFFAOYSA-N
TotalMolweight	407.473
Molweight	407.473
MonoisotopicMass	407.039832
CLogP	3.0427
CLogS	-5.252
H Acceptors	6
H Donors	1
TotalSurfaceArea	295.29
Relative PSA	0.3483
PolarSurfaceArea	146.6
Druglikeness	0.51227
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	1
Symmetricatoms	3
Amides	1
Aromatic Nitrogens	1
StereoCon

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