N-[(E)-[amino(pyrazin-2-yl)methylidene]amino]-2-[1-(1-benzofuran-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide

Formula:C23H21N7O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-[amino(pyrazin-2-yl)methylidene]amino]-2-[1-(1-benzofuran-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide is a drug-like molecule.

MolName	N-[(E)-[amino(pyrazin-2-yl)methylidene]amino]-2-[1-(1-benzofuran-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide
MolecularFormula	C23H21N7O3S
Smiles	N/C(/c1nccnc1)=N/NC(c1csc(C(CC2)CCN2C(c2cc(cccc3)c3o2)=O)n1)=O
InChI	InChI=1S/C23H21N7O3S/c24-20(16-12-25-7-8-26-16)28-29-21(31)17-13-34-22(27-17)14-5-9-30(10-6-14)23(32)19-11-15-3-1-2-4-18(15)33-19/h1-4,7-8,11-14H,5-6,9-10H2,(H2,24,28)(H,29,31)
InChIK	BVAXPOOOMXPKCZ-UHFFFAOYSA-N
TotalMolweight	475.532
Molweight	475.532
MonoisotopicMass	475.142658
CLogP	2.3802
CLogS	-3.989
H Acceptors	10
H Donors	2
TotalSurfaceArea	352.08
Relative PSA	0.38415
PolarSurfaceArea	167.84
Druglikeness	8.2829
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	5
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	3
StereoCon

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