N-[(E)-(6,8-dichloro-2-phenylchromen-4-ylidene)amino]-1,3-benzothiazol-2-amine

Formula:C22H13N3OCl2S Mutagenic:none Tumorigenic:high Reproductive Effective:high N-[(E)-(6,8-dichloro-2-phenylchromen-4-ylidene)amino]-1,3-benzothiazol-2-amine is not a drug-like molecule.

MolName	N-[(E)-(6,8-dichloro-2-phenylchromen-4-ylidene)amino]-1,3-benzothiazol-2-amine
MolecularFormula	C22H13N3OCl2S
Smiles	Clc(cc12)cc(Cl)c1OC(c1ccccc1)=C/C2=N\Nc1nc(cccc2)c2s1
InChI	InChI=1S/C22H13Cl2N3OS/c23-14-10-15-18(26-27-22-25-17-8-4-5-9-20(17)29-22)12-19(13-6-2-1-3-7-13)28-21(15)16(24)11-14/h1-12H,(H,25,27)
InChIK	PHZWTAFLSNHUQK-UHFFFAOYSA-N
TotalMolweight	438.337
Molweight	438.337
MonoisotopicMass	437.015636
CLogP	8.6352
CLogS	-7.392
H Acceptors	4
H Donors	1
TotalSurfaceArea	308.56
Relative PSA	0.20839
PolarSurfaceArea	74.75
Druglikeness	1.9465
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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1 - N-[(E)-(6,8-dichloro-2-phenylchromen-4-ylidene)amino]-1,3-benzothiazol-2-amine | 2 - N-[(E)-(6,8-dichloro-2-phenylchromen-4-ylidene)amino]-1,3-benzothiazol-2-amine

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