[2-(carbamoylamino)-2-oxoethyl] (E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoate

Formula:C19H16N4O4S Mutagenic:low Tumorigenic:low Reproductive Effective:low [2-(carbamoylamino)-2-oxoethyl] (E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-(carbamoylamino)-2-oxoethyl] (E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoate
MolecularFormula	C19H16N4O4S
Smiles	NC(NC(COC(/C=C/c1cn(-c2ccccc2)nc1-c1cccs1)=O)=O)=O
InChI	InChI=1S/C19H16N4O4S/c20-19(26)21-16(24)12-27-17(25)9-8-13-11-23(14-5-2-1-3-6-14)22-18(13)15-7-4-10-28-15/h1-11H,12H2,(H3,20,21,24,26)
InChIK	VVGBVOZPRCQZHO-UHFFFAOYSA-N
TotalMolweight	396.426
Molweight	396.426
MonoisotopicMass	396.089226
CLogP	1.3622
CLogS	-3.873
H Acceptors	8
H Donors	2
TotalSurfaceArea	300.17
Relative PSA	0.37995
PolarSurfaceArea	144.55
Druglikeness	4.6948
Mutagenic	low
Tumorigenic	low
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	2
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	2
StereoCon

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