1-[[2-(5-aminotetrazol-1-yl)acetyl]-benzylamino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide

Formula:C24H29N7O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-[[2-(5-aminotetrazol-1-yl)acetyl]-benzylamino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide is a drug-like molecule.

MolName	1-[[2-(5-aminotetrazol-1-yl)acetyl]-benzylamino]-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
MolecularFormula	C24H29N7O3
Smiles	COc(cc1)ccc1NC(C1(CCCCC1)N(Cc1ccccc1)C(Cn1nnnc1N)=O)=O
InChI	InChI=1S/C24H29N7O3/c1-34-20-12-10-19(11-13-20)26-22(33)24(14-6-3-7-15-24)30(16-18-8-4-2-5-9-18)21(32)17-31-23(25)27-28-29-31/h2,4-5,8-13H,3,6-7,14-17H2,1H3,(H,26,33)(H2,25,27,29)
InChIK	WBXCLNZSVKCJTI-UHFFFAOYSA-N
TotalMolweight	463.54
Molweight	463.54
MonoisotopicMass	463.233188
CLogP	1.9317
CLogS	-4.402
H Acceptors	10
H Donors	2
TotalSurfaceArea	359.53
Relative PSA	0.29522
PolarSurfaceArea	128.26
Druglikeness	0.32945
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.44118
Fragments	1
Non HAtoms	34
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	10
Symmetricatoms	6
Amides	2
Aromatic Nitrogens	4
StereoCon

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