In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 21 | Yes |
Popular Name: (2S)-N-(4-amino-2-methoxy-phenyl)-2-[2-cyanoethyl(ethyl)amino]propanamide (2S)-N-(4-amino-2-methoxy-phenyl…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.37 | 4.24 | -47.6 | 4 | 6 | 1 | 93 | 291.375 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.37 | 2.24 | -12.33 | 3 | 6 | 0 | 91 | 290.367 | 7 | ↓ |