4-amino-N-[(Z)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]benzamide

Formula:C18H20N4OCl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high 4-amino-N-[(Z)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]benzamide is a drug-like molecule.

MolName	4-amino-N-[(Z)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]benzamide
MolecularFormula	C18H20N4OCl2
Smiles	Nc(cc1)ccc1C(N/N=C\c(cc1)ccc1N(CCCl)CCCl)=O
InChI	InChI=1S/C18H20Cl2N4O/c19-9-11-24(12-10-20)17-7-1-14(2-8-17)13-22-23-18(25)15-3-5-16(21)6-4-15/h1-8,13H,9-12,21H2,(H,23,25)
InChIK	AOWKPAWXZIGNML-UHFFFAOYSA-N
TotalMolweight	379.29
Molweight	379.29
MonoisotopicMass	378.101415
CLogP	3.6919
CLogS	-5.235
H Acceptors	5
H Donors	2
TotalSurfaceArea	291.69
Relative PSA	0.18797
PolarSurfaceArea	70.72
Druglikeness	7.3091
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	7
Amines	2
Aromatic Amines	2
StereoCon

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