Galaxy |

SMILES to SMILES (version 1.0.0)

Molecules in SD-format:

Do not include isotopic or chiral markings (-xi):

Output in canonical form (-xc):

Output explicit hydrogens as such (-xh):

Delete hydrogen atoms (-d):

Add hydrogens appropriate for pH (-p):

-1 means deactivated

Convert dative bonds (e.g. [N+]([O-])=O to N(=O)=O) (-b):