N-[(Z)-(6-fluoro-2,3-dihydrochromen-4-ylidene)amino]-4-nitroaniline

Formula:C15H12N3O3F Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(6-fluoro-2,3-dihydrochromen-4-ylidene)amino]-4-nitroaniline is a drug-like molecule.

MolName	N-[(Z)-(6-fluoro-2,3-dihydrochromen-4-ylidene)amino]-4-nitroaniline
MolecularFormula	C15H12N3O3F
Smiles	[O-][N+](c(cc1)ccc1N/N=C1\c(cc(cc2)F)c2OCC1)=O
InChI	InChI=1S/C15H12FN3O3/c16-10-1-6-15-13(9-10)14(7-8-22-15)18-17-11-2-4-12(5-3-11)19(20)21/h1-6,9,17H,7-8H2
InChIK	QFOCMFRJLRIILU-UHFFFAOYSA-N
TotalMolweight	301.276
Molweight	301.276
MonoisotopicMass	301.08627
CLogP	4.1038
CLogS	-4.417
H Acceptors	6
H Donors	1
TotalSurfaceArea	221.49
Relative PSA	0.2862
PolarSurfaceArea	79.44
Druglikeness	-5.8025
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.59091
Fragments	1
Non HAtoms	22
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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