CCCCC(=O)Nc1ccc(C(=O)N(CCN2CCC(C(=O)c3ccc(F)cc3)CC2)c2cccnc2)cc1
الاسم: N-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-4-(pentanoylamino)-N-pyridin-3-ylbenzamide
SMILES: CCCCC(=O)Nc1ccc(C(=O)N(CCN2CCC(C(=O)c3ccc(F)cc3)CC2)c2cccnc2)cc1

Molecular Processing

Molecular formula
C31H35FN4O3
Molecular weight
530.64
Exact mass
530.2693
XLogP
5.59
TPSA
82.61
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
11
Heavy atoms
39
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.355
Molar refractivity
150.4

Supplementary Information

InChIKey: WAMPABKFLPGURF-UHFFFAOYSA-N
مرادفات
SCHEMBL8711048WAMPABKFLPGURF-UHFFFAOYSA-N4-valerylamino-N-{2-[4-(4-fluorobenzoyl)piperidino]-ethyl}-N-(3-pyridyl)benzamide
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