Molecule Input via JME

Molecule smiles

mol file



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bonds -,=,# rings 3..8, Ph is 1, furyl 0 atoms C,N,O,P,S,F,L,B,I,H groups t - tert.butyl, ft - CF3, y - nitro, a - COOH, z - SO3H
d - delete Esc - return to the standard state (C, single bond)
molecule may by moved by "dragging" free space and rotated by pressing concurrently also the shift key

DiTaD RxnIP Hu Lab College of Pharmacy Wuhan University