2-N-[(Z)-naphthalen-2-ylmethylideneamino]-4-N-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine

Formula:C24H23N7 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-N-[(Z)-naphthalen-2-ylmethylideneamino]-4-N-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine is not a drug-like molecule.

MolName	2-N-[(Z)-naphthalen-2-ylmethylideneamino]-4-N-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
MolecularFormula	C24H23N7
Smiles	C(CC1)CN1c1nc(N/N=C\c2cc3ccccc3cc2)nc(Nc2ccccc2)n1
InChI	InChI=1S/C24H23N7/c1-2-10-21(11-3-1)26-22-27-23(29-24(28-22)31-14-6-7-15-31)30-25-17-18-12-13-19-8-4-5-9-20(19)16-18/h1-5,8-13,16-17H,6-7,14-15H2,(H2,26,27,28,29,30)
InChIK	CXXZKFBJSXLZTI-UHFFFAOYSA-N
TotalMolweight	409.496
Molweight	409.496
MonoisotopicMass	409.201493
CLogP	7.4783
CLogS	-7.241
H Acceptors	7
H Donors	2
TotalSurfaceArea	323.18
Relative PSA	0.21935
PolarSurfaceArea	78.33
Druglikeness	4.3575
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.54839
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	4
Symmetricatoms	4
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

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