4-chloro-N-[(2S)-1-[(2Z)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]benzamide

Formula:C25H20N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-chloro-N-[(2S)-1-[(2Z)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]benzamide is not a drug-like molecule.

MolName	4-chloro-N-[(2S)-1-[(2Z)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]benzamide
MolecularFormula	C25H20N4O2Cl2
Smiles	O=C([C@H](Cc1c[nH]c2c1cccc2)NC(c(cc1)ccc1Cl)=O)N/N=C\c(cc1)ccc1Cl
InChI	InChI=1S/C25H20Cl2N4O2/c26-19-9-5-16(6-10-19)14-29-31-25(33)23(30-24(32)17-7-11-20(27)12-8-17)13-18-15-28-22-4-2-1-3-21(18)22/h1-12,14-15,23,28H,13H2,(H,30,32)(H,31,33)/t23-/m0/s1
InChIK	CPDRLVSAFBXIOU-QHCPKHFHSA-N
TotalMolweight	479.366
Molweight	479.366
MonoisotopicMass	478.09633
CLogP	5.3379
CLogS	-6.998
H Acceptors	6
H Donors	3
TotalSurfaceArea	357.23
Relative PSA	0.20855
PolarSurfaceArea	86.35
Druglikeness	7.2605
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	8
Electronegative Atoms	8
StereoCenters	1
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Symmetricatoms	4
Amides	1
Aromatic Nitrogens	1
StereoCon	this enantiomer

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1 - 4-chloro-N-[(2S)-1-[(2Z)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]benzamide | 2 - 4-chloro-N-[(2S)-1-[(2Z)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]benzamide

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