الاسم: 1b
SMILES:
CCOC(=O)[C@@]12C[C@@H]1/C=C\CCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H](Oc3nc4ccccc4nc3Cl)C[C@H]1C(=O)N2Molecular Processing
Molecular formula
C33H42ClN5O7
Molecular weight
656.18
Exact mass
655.2773
XLogP
4.48
TPSA
149.05
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
46
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.576
Molar refractivity
170.08
Supplementary Information
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