|
TPSA calculated by cactvs
|
CHEMINF_000392 |
|
|
TPSA
|
CHEMINF_000174 |
|
|
canonical SMILES format specification
|
CHEMINF_000151 |
|
|
XLogP3 software library
|
CHEMINF_000393 |
|
|
topological polar surface area descriptor
|
CHEMINF_000152 |
|
|
topological surface area descriptor
|
CHEMINF_000146 |
|
|
XLogP3 software library version 3.0
|
CHEMINF_000394 |
|
|
atom counting algorithm
|
CHEMINF_001000 |
|
|
charge weighted partial negative surface area
|
CHEMINF_000153 |
|
|
xlogp3 calculated by the xlogp3 software
|
CHEMINF_000395 |
|
|
DPSA-1
|
CHEMINF_000154 |
|
|
InChI calculated by library version 1.0.4
|
CHEMINF_000396 |
|
|
InChI descriptor
|
CHEMINF_000113 |
|
|
Cactvs software library version 3.408
|
CHEMINF_000386 |
|
|
hydrogen bond donor count calculated by cactvs
|
CHEMINF_000387 |
|
|
hydrogen bond acceptor count calculated by cactvs
|
CHEMINF_000388 |
|
|
parameterized software execution
|
CHEMINF_000147 |
|
|
rotatable bond count calculated by cactvs
|
CHEMINF_000389 |
|
|
generic SMILES descriptor
|
CHEMINF_000149 |
|
|
FNSA-1
|
CHEMINF_000160 |
|
