[(E)-[1-amino-3-[2,1,3-benzothiadiazol-4-ylsulfonyl(furan-2-ylmethyl)amino]propylidene]amino] N-phenylcarbamate

Formula:C21H20N6O5S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(E)-[1-amino-3-[2,1,3-benzothiadiazol-4-ylsulfonyl(furan-2-ylmethyl)amino]propylidene]amino] N-phenylcarbamate is not a drug-like molecule.

MolName	[(E)-[1-amino-3-[2,1,3-benzothiadiazol-4-ylsulfonyl(furan-2-ylmethyl)amino]propylidene]amino] N-phenylcarbamate
MolecularFormula	C21H20N6O5S2
Smiles	N/C(/CCN(Cc1ccco1)S(c1cccc2nsnc12)(=O)=O)=N/OC(Nc1ccccc1)=O
InChI	InChI=1S/C21H20N6O5S2/c22-19(24-32-21(28)23-15-6-2-1-3-7-15)11-12-27(14-16-8-5-13-31-16)34(29,30)18-10-4-9-17-20(18)26-33-25-17/h1-10,13H,11-12,14H2,(H2,22,24)(H,23,28)
InChIK	WFXTYIWJGPFESD-UHFFFAOYSA-N
TotalMolweight	500.559
Molweight	500.559
MonoisotopicMass	500.093659
CLogP	3.5073
CLogS	-0.86
H Acceptors	11
H Donors	2
TotalSurfaceArea	361.39
Relative PSA	0.41457
PolarSurfaceArea	189.63
Druglikeness	-3.3155
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	34
NonCHAtoms	13
Electronegative Atoms	13
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	5
Symmetricatoms	3
Amides	2
Aromatic Nitrogens	2
StereoCon

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1 - [(E)-[1-amino-3-[2,1,3-benzothiadiazol-4-ylsulfonyl(furan-2-ylmethyl)amino]propylidene]amino] N-phenylcarbamate | 2 - [(E)-[1-amino-3-[2,1,3-benzothiadiazol-4-ylsulfonyl(furan-2-ylmethyl)amino]propylidene]amino] N-phenylcarbamate

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