CCCCc1nc2c(N)nc3c(c2n1CCNC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)NCCC3
SMILES: CCCCc1nc2c(N)nc3c(c2n1CCNC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)NCCC3

Molecular Processing

Molecular formula
C30H44N6O2
Molecular weight
520.72
Exact mass
520.3526
XLogP
5.44
TPSA
118.09
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.567
Molar refractivity
155.2

Supplementary Information

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