[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Formula:C26H20N3O3ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate is a drug-like molecule.

MolName	[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
MolecularFormula	C26H20N3O3ClS
Smiles	O=C(COC(c1c(CCC/C2=C\c3cccs3)c2nc2ccccc12)=O)Nc1cccnc1Cl
InChI	InChI=1S/C26H20ClN3O3S/c27-25-21(11-4-12-28-25)29-22(31)15-33-26(32)23-18-8-1-2-10-20(18)30-24-16(6-3-9-19(23)24)14-17-7-5-13-34-17/h1-2,4-5,7-8,10-14H,3,6,9,15H2,(H,29,31)
InChIK	RXZXHJAJNSCVDK-UHFFFAOYSA-N
TotalMolweight	489.982
Molweight	489.982
MonoisotopicMass	489.091389
CLogP	4.9577
CLogS	-5.929
H Acceptors	6
H Donors	1
TotalSurfaceArea	359.47
Relative PSA	0.24992
PolarSurfaceArea	109.42
Druglikeness	1.5442
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	34
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	5
Amides	1
Aromatic Nitrogens	2
StereoCon

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1 - [2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate | 2 - [2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

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