N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline

Formula:C19H20N4O4S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline is a drug-like molecule.

MolName	N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline
MolecularFormula	C19H20N4O4S
Smiles	[O-][N+](c(cc(cc1)S(N2CCCC2)(=O)=O)c1N/N=C(/CC1)\c2c1cccc2)=O
InChI	InChI=1S/C19H20N4O4S/c24-23(25)19-13-15(28(26,27)22-11-3-4-12-22)8-10-18(19)21-20-17-9-7-14-5-1-2-6-16(14)17/h1-2,5-6,8,10,13,21H,3-4,7,9,11-12H2
InChIK	BMMPXUFUWWRRNB-UHFFFAOYSA-N
TotalMolweight	400.458
Molweight	400.458
MonoisotopicMass	400.120526
CLogP	4.1148
CLogS	-4.113
H Acceptors	8
H Donors	1
TotalSurfaceArea	285.56
Relative PSA	0.29948
PolarSurfaceArea	115.97
Druglikeness	-4.3696
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53571
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	3
Amides	1
AcidicOxygens	1
StereoCon

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