이름: ethyl 1-[N2 -(3-butoxy-2,4-dimethoxyphenylsulfonyl)-L-arginyl]-4-methyl-2-piperidinecarboxylate acetate
SMILES:
CC(=O)O.CCCCOc1c(OC)ccc(S(=O)(=O)N[C@@H](CCCNC(=N)N)C(=O)N2CCC(C)CC2C(=O)OCC)c1OCMolecular Processing
Molecular formula
C29H49N5O10S
Molecular weight
659.8
Exact mass
659.32
XLogP
2.07
TPSA
219.67
H-bond donors
5
H-bond acceptors
10
Rotatable bonds
16
Heavy atoms
45
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
2
Formal charge
0
Heteroatoms
16
Covalent units
2
Fraction Csp3
0.655
Molar refractivity
167.05
Supplementary Information
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