N-[(Z)-(2-piperidin-1-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)methylideneamino]pyridine-3-carboxamide

Formula:C19H19N5OS2 Mutagenic:high Tumorigenic:none Reproductive Effective:none N-[(Z)-(2-piperidin-1-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)methylideneamino]pyridine-3-carboxamide is a drug-like molecule.

MolName	N-[(Z)-(2-piperidin-1-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)methylideneamino]pyridine-3-carboxamide
MolecularFormula	C19H19N5OS2
Smiles	O=C(c1cnccc1)N/N=C\c1c(-c2cccs2)nc(N2CCCCC2)s1
InChI	InChI=1S/C19H19N5OS2/c25-18(14-6-4-8-20-12-14)23-21-13-16-17(15-7-5-11-26-15)22-19(27-16)24-9-2-1-3-10-24/h4-8,11-13H,1-3,9-10H2,(H,23,25)
InChIK	OTJKISFLGCHUEH-UHFFFAOYSA-N
TotalMolweight	397.526
Molweight	397.526
MonoisotopicMass	397.1031
CLogP	4.5149
CLogS	-5.46
H Acceptors	6
H Donors	1
TotalSurfaceArea	301.75
Relative PSA	0.33876
PolarSurfaceArea	126.96
Druglikeness	6.0231
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	5
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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