(E)-3-[5-(2,3-dichlorophenyl)furan-2-yl]-N-[2-(4-fluorophenyl)benzotriazol-5-yl]prop-2-enamide

Formula:C25H15N4O2Cl2F Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-[5-(2,3-dichlorophenyl)furan-2-yl]-N-[2-(4-fluorophenyl)benzotriazol-5-yl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-[5-(2,3-dichlorophenyl)furan-2-yl]-N-[2-(4-fluorophenyl)benzotriazol-5-yl]prop-2-enamide
MolecularFormula	C25H15N4O2Cl2F
Smiles	O=C(/C=C/c1ccc(-c2cccc(Cl)c2Cl)o1)Nc1cc2nn(-c(cc3)ccc3F)nc2cc1
InChI	InChI=1S/C25H15Cl2FN4O2/c26-20-3-1-2-19(25(20)27)23-12-9-18(34-23)10-13-24(33)29-16-6-11-21-22(14-16)31-32(30-21)17-7-4-15(28)5-8-17/h1-14H,(H,29,33)
InChIK	BPXHZGOUCMEAFT-UHFFFAOYSA-N
TotalMolweight	493.324
Molweight	493.324
MonoisotopicMass	492.055608
CLogP	6.0643
CLogS	-7.665
H Acceptors	6
H Donors	1
TotalSurfaceArea	356.45
Relative PSA	0.18914
PolarSurfaceArea	72.95
Druglikeness	2.4053
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	26
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	3
StereoCon

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