[(E)-[6-bromo-3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]chromen-2-ylidene]amino]thiourea

Formula:C19H12N4OBr2S2 Mutagenic:high Tumorigenic:none Reproductive Effective:none [(E)-[6-bromo-3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]chromen-2-ylidene]amino]thiourea is not a drug-like molecule.

MolName	[(E)-[6-bromo-3-[4-(4-bromophenyl)-1,3-thiazol-2-yl]chromen-2-ylidene]amino]thiourea
MolecularFormula	C19H12N4OBr2S2
Smiles	NC(N/N=C1/Oc(ccc(Br)c2)c2C=C1c1nc(-c(cc2)ccc2Br)cs1)=S
InChI	InChI=1S/C19H12Br2N4OS2/c20-12-3-1-10(2-4-12)15-9-28-18(23-15)14-8-11-7-13(21)5-6-16(11)26-17(14)24-25-19(22)27/h1-9H,(H3,22,25,27)
InChIK	UKLWKOHWVMCADY-UHFFFAOYSA-N
TotalMolweight	536.271
Molweight	536.271
MonoisotopicMass	533.881923
CLogP	4.7224
CLogS	-6.761
H Acceptors	5
H Donors	2
TotalSurfaceArea	321.61
Relative PSA	0.33447
PolarSurfaceArea	132.86
Druglikeness	2.3097
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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