4-phenylmethoxy-N-[(Z)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide

Formula:C37H30N4O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-phenylmethoxy-N-[(Z)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide is not a drug-like molecule.

MolName	4-phenylmethoxy-N-[(Z)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide
MolecularFormula	C37H30N4O3
Smiles	O=C(c(cc1)ccc1OCc1ccccc1)N/N=C\c1cn(-c2ccccc2)nc1-c(cc1)ccc1OCc1ccccc1
InChI	InChI=1S/C37H30N4O3/c42-37(31-18-22-35(23-19-31)44-27-29-12-6-2-7-13-29)39-38-24-32-25-41(33-14-8-3-9-15-33)40-36(32)30-16-20-34(21-17-30)43-26-28-10-4-1-5-11-28/h1-25H,26-27H2,(H,39,42)
InChIK	DKKNUIDCXGCEFR-UHFFFAOYSA-N
TotalMolweight	578.67
Molweight	578.67
MonoisotopicMass	578.231791
CLogP	6.8168
CLogS	-7.916
H Acceptors	7
H Donors	1
TotalSurfaceArea	461.51
Relative PSA	0.16002
PolarSurfaceArea	77.74
Druglikeness	5.5525
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.59091
Fragments	1
Non HAtoms	44
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	11
Rings Closures	6
Small Rings	6
Aromatic Rings	6
Aromatic Atoms	35
Sp3Atoms	4
Symmetricatoms	10
Aromatic Nitrogens	2
StereoCon

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