O=C(Nc1ncc(F)s1)[C@H](C[C@H]1CCNC1)c1ccc(S(=O)(=O)C2CC2)cc1
이름: (R)-2-(4-(Cyclopropylsulfonyl)phenyl)-N-(5-fluorothiazol-2-yl)-3-((S)-pyrrolidin-3-yl)propanamide
SMILES: O=C(Nc1ncc(F)s1)[C@H](C[C@H]1CCNC1)c1ccc(S(=O)(=O)C2CC2)cc1

Molecular Processing

Molecular formula
C19H22FN3O3S2
Molecular weight
423.54
Exact mass
423.1087
XLogP
2.94
TPSA
88.16
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
105.69

Supplementary Information

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