N-[(Z)-[1-[(2,4-dichlorophenyl)methyl]indol-3-yl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine

Formula:C28H29N7Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[1-[(2,4-dichlorophenyl)methyl]indol-3-yl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine is not a drug-like molecule.

MolName	N-[(Z)-[1-[(2,4-dichlorophenyl)methyl]indol-3-yl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine
MolecularFormula	C28H29N7Cl2
Smiles	Clc1cc(Cl)c(Cn2c(cccc3)c3c(/C=N\Nc3nc(N4CCCC4)nc(N4CCCC4)c3)c2)cc1
InChI	InChI=1S/C28H29Cl2N7/c29-22-10-9-20(24(30)15-22)18-37-19-21(23-7-1-2-8-25(23)37)17-31-34-26-16-27(35-11-3-4-12-35)33-28(32-26)36-13-5-6-14-36/h1-2,7-10,15-17,19H,3-6,11-14,18H2,(H,32,33,34)
InChIK	GIWFMBCOMPYLSA-UHFFFAOYSA-N
TotalMolweight	534.493
Molweight	534.493
MonoisotopicMass	533.186147
CLogP	8.0737
CLogS	-7.36
H Acceptors	7
H Donors	1
TotalSurfaceArea	398.6
Relative PSA	0.14772
PolarSurfaceArea	61.58
Druglikeness	4.4285
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.48649
Fragments	1
Non HAtoms	37
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	6
Small Rings	6
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	9
Symmetricatoms	4
Aromatic Nitrogens	3
BasicNitrogens	2
StereoCon

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1 - N-[(Z)-[1-[(2,4-dichlorophenyl)methyl]indol-3-yl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine | 2 - N-[(Z)-[1-[(2,4-dichlorophenyl)methyl]indol-3-yl]methylideneamino]-2,6-dipyrrolidin-1-ylpyrimidin-4-amine

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