N-[(Z)-[1-(4-bromophenyl)-2,5-diphenylpyrrol-3-yl]methylideneamino]-2-(9-oxoacridin-10-yl)acetamide

Formula:C38H27N4O2Br Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[1-(4-bromophenyl)-2,5-diphenylpyrrol-3-yl]methylideneamino]-2-(9-oxoacridin-10-yl)acetamide is not a drug-like molecule.

MolName	N-[(Z)-[1-(4-bromophenyl)-2,5-diphenylpyrrol-3-yl]methylideneamino]-2-(9-oxoacridin-10-yl)acetamide
MolecularFormula	C38H27N4O2Br
Smiles	O=C(CN(c1c2cccc1)c(cccc1)c1C2=O)N/N=C\c(cc1-c2ccccc2)c(-c2ccccc2)n1-c(cc1)ccc1Br
InChI	InChI=1S/C38H27BrN4O2/c39-29-19-21-30(22-20-29)43-35(26-11-3-1-4-12-26)23-28(37(43)27-13-5-2-6-14-27)24-40-41-36(44)25-42-33-17-9-7-15-31(33)38(45)32-16-8-10-18-34(32)42/h1-24H,25H2,(H,41,44)
InChIK	KKQTUOMXPWVPRC-UHFFFAOYSA-N
TotalMolweight	651.562
Molweight	651.562
MonoisotopicMass	650.131737
CLogP	8.7184
CLogS	-13.256
H Acceptors	6
H Donors	1
TotalSurfaceArea	462.17
Relative PSA	0.12868
PolarSurfaceArea	66.7
Druglikeness	4.8362
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.4
Fragments	1
Non HAtoms	45
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	7
Small Rings	7
Aromatic Rings	6
Aromatic Atoms	35
Sp3Atoms	2
Symmetricatoms	12
Amines	1
Aromatic Amines	1
Aromatic Nitrogens	1
StereoCon

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