CC1(C)CC(Nc2nc(Cl)ncc2F)CC2CCC(=O)N21
이름: 7-(2-chloro-5-fluoropyrimidin-4-ylamino)-hexahydro-5,5-dimethylindolizin-3(5H)-one
SMILES: CC1(C)CC(Nc2nc(Cl)ncc2F)CC2CCC(=O)N21

Molecular Processing

Molecular formula
C14H18ClFN4O
Molecular weight
312.78
Exact mass
312.1153
XLogP
2.61
TPSA
58.12
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.643
Molar refractivity
77.59

Supplementary Information

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