| 1 |
maxHssNH |
−0.35 |
Maximum atom-type H E-state: –NH– |
| 2 |
maxHbint6 |
−0.51 |
Maximum E-State descriptors of strength for potential hydrogen bonds of path length 6 |
| 3 |
EE_Dt |
−0.42 |
Estrada-like index from detour matrix |
| 4 |
hmax |
−0.3 |
Maximum H E-state |
| 5 |
ATSC1s |
0.42 |
Centered Broto-Moreau autocorrelation − lag 1/weighted by I-state |
| 6 |
AAS1i |
−0.25 |
Average Broto-Moreau autocorrelation − lag 1/weighted by first ionization potential |
| 7 |
SHsOH |
−0.35 |
Sum of atom-type H E-State: –OH |
| 8 |
maxHBint2 |
−0.39 |
Maximum E-state descriptors of strength for potential hydrogen bonds of path length 2 |
| 9 |
ETA_Epslion_5 |
−0.02 |
A measure of electronegative atom count |
| 10 |
maxHBint7 |
−0.49 |
Maximum E-state descriptors of strength for potential hydrogen bonds of path length 7 |
| 12 |
nHBa |
−0.56 |
Count of E-states for (strong) hydrogen bond acceptors |