Name: Compound 215
SMILES:
Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=NC1(CC1C)c1nnc(C)n1-2Molecular Processing
Molecular formula
C20H19ClN4S
Molecular weight
382.92
Exact mass
382.1019
XLogP
4.99
TPSA
43.07
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
26
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
106
Supplementary Information
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