N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide

Formula:C15H12N4O2S Mutagenic:high Tumorigenic:none Reproductive Effective:none N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide is a drug-like molecule.

MolName	N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide
MolecularFormula	C15H12N4O2S
Smiles	O=C(c1n[nH]c(-c2cccs2)c1)N/N=C\C=C\c1ccco1
InChI	InChI=1S/C15H12N4O2S/c20-15(19-16-7-1-4-11-5-2-8-21-11)13-10-12(17-18-13)14-6-3-9-22-14/h1-10H,(H,17,18)(H,19,20)
InChIK	DWQGXBJMAFFYLZ-UHFFFAOYSA-N
TotalMolweight	312.352
Molweight	312.352
MonoisotopicMass	312.068096
CLogP	2.1299
CLogS	-3.991
H Acceptors	6
H Donors	2
TotalSurfaceArea	247.21
Relative PSA	0.38607
PolarSurfaceArea	111.52
Druglikeness	7.1049
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.68182
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Aromatic Nitrogens	2
StereoCon

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