SMILES:
Cc1cccc(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCNC(N)=O)CN2CCc3cc(F)ccc32)c1Molecular Processing
Molecular formula
C27H36FN5O3
Molecular weight
497.62
Exact mass
497.2802
XLogP
2.88
TPSA
116.56
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
36
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
138.34
Supplementary Information
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