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

Formula:C23H23N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-(cyclopentylamino)-2-oxoethyl] (E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-(cyclopentylamino)-2-oxoethyl] (E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoate
MolecularFormula	C23H23N3O3S
Smiles	O=C(COC(/C=C/c1cn(-c2ccccc2)nc1-c1cccs1)=O)NC1CCCC1
InChI	InChI=1S/C23H23N3O3S/c27-21(24-18-7-4-5-8-18)16-29-22(28)13-12-17-15-26(19-9-2-1-3-10-19)25-23(17)20-11-6-14-30-20/h1-3,6,9-15,18H,4-5,7-8,16H2,(H,24,27)
InChIK	HHJHGISEMOEXGP-UHFFFAOYSA-N
TotalMolweight	421.52
Molweight	421.52
MonoisotopicMass	421.146012
CLogP	3.1417
CLogS	-4.632
H Acceptors	6
H Donors	1
TotalSurfaceArea	327.94
Relative PSA	0.26145
PolarSurfaceArea	101.46
Druglikeness	2.0096
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.56667
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	7
Symmetricatoms	4
Amides	1
Aromatic Nitrogens	2
StereoCon

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