In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: (2S)-2-amino-N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-butanediamide (2S)-2-amino-N-[(5-bromo-2-metho…
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) | 0.94 | 1.78 | -38.91 | 5 | 6 | 1 | 100 | 345.217 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.94 | 1.43 | -10.89 | 4 | 6 | 0 | 99 | 344.209 | 6 | ↓ |