N-[(Z)-2H-chromen-3-ylmethylideneamino]-5-phenylthieno[2,3-d]pyrimidin-4-amine

Formula:C22H16N4OS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-2H-chromen-3-ylmethylideneamino]-5-phenylthieno[2,3-d]pyrimidin-4-amine is not a drug-like molecule.

MolName	N-[(Z)-2H-chromen-3-ylmethylideneamino]-5-phenylthieno[2,3-d]pyrimidin-4-amine
MolecularFormula	C22H16N4OS
Smiles	C1Oc(cccc2)c2C=C1/C=N\Nc1c(c(-c2ccccc2)cs2)c2ncn1
InChI	InChI=1S/C22H16N4OS/c1-2-6-16(7-3-1)18-13-28-22-20(18)21(23-14-24-22)26-25-11-15-10-17-8-4-5-9-19(17)27-12-15/h1-11,13-14H,12H2,(H,23,24,26)
InChIK	QCHAUOTXTRVISY-UHFFFAOYSA-N
TotalMolweight	384.462
Molweight	384.462
MonoisotopicMass	384.104481
CLogP	6.0956
CLogS	-7.002
H Acceptors	5
H Donors	1
TotalSurfaceArea	292.03
Relative PSA	0.25775
PolarSurfaceArea	87.64
Druglikeness	2.515
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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