1-(1,3-benzoxazol-2-yl)-2-benzylsulfonylguanidine

Formula:C15H14N4O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-(1,3-benzoxazol-2-yl)-2-benzylsulfonylguanidine is a drug-like molecule.

MolName	1-(1,3-benzoxazol-2-yl)-2-benzylsulfonylguanidine
MolecularFormula	C15H14N4O3S
Smiles	N/C(/Nc1nc(cccc2)c2o1)=N/S(Cc1ccccc1)(=O)=O
InChI	InChI=1S/C15H14N4O3S/c16-14(18-15-17-12-8-4-5-9-13(12)22-15)19-23(20,21)10-11-6-2-1-3-7-11/h1-9H,10H2,(H3,16,17,18,19)
InChIK	RZAIQRYFBDAHMA-UHFFFAOYSA-N
TotalMolweight	330.367
Molweight	330.367
MonoisotopicMass	330.078661
CLogP	2.5585
CLogS	-5.764
H Acceptors	7
H Donors	2
TotalSurfaceArea	241.36
Relative PSA	0.38076
PolarSurfaceArea	118.96
Druglikeness	-4.5153
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	2
Symmetricatoms	3
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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