الاسم: 2-benzyloxycarbonylamino-2-methyl-N-[2,3,4,5-tetrahydro-2-oxo-1-[[2'-[(t-butoxycarbonylamino)methyl][1,1'-biphenyl]-4-yl]methyl]-1H-benzazepin-3(R)-yl]propanamide
SMILES:
CC(C)(C)OC(=O)NCc1ccccc1-c1ccc(CN2C(=O)[C@H](NC(=O)C(C)(C)NC(=O)OCc3ccccc3)CCc3ccccc32)cc1Molecular Processing
Molecular formula
C41H46N4O6
Molecular weight
690.84
Exact mass
690.3417
XLogP
7.05
TPSA
126.07
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
51
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.317
Molar refractivity
196.68
Supplementary Information
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