7-chloro-N-[(E)-(5-chloro-2,3-dihydroinden-1-ylidene)amino]quinolin-4-amine

Formula:C18H13N3Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 7-chloro-N-[(E)-(5-chloro-2,3-dihydroinden-1-ylidene)amino]quinolin-4-amine is not a drug-like molecule.

MolName	7-chloro-N-[(E)-(5-chloro-2,3-dihydroinden-1-ylidene)amino]quinolin-4-amine
MolecularFormula	C18H13N3Cl2
Smiles	Clc(cc1)cc(CC2)c1/C2=N/Nc1c(ccc(Cl)c2)c2ncc1
InChI	InChI=1S/C18H13Cl2N3/c19-12-2-4-14-11(9-12)1-6-16(14)22-23-17-7-8-21-18-10-13(20)3-5-15(17)18/h2-5,7-10H,1,6H2,(H,21,23)
InChIK	SAYKMTZTAXIFSX-UHFFFAOYSA-N
TotalMolweight	342.228
Molweight	342.228
MonoisotopicMass	341.048651
CLogP	6.6996
CLogS	-6.006
H Acceptors	3
H Donors	1
TotalSurfaceArea	245.67
Relative PSA	0.13815
PolarSurfaceArea	37.28
Druglikeness	0.34663
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	2
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	2
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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