In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: (2S)-2-[(2-bromo-4,5-dimethoxy-phenyl)methylamino]-N-ethyl-propanamide (2S)-2-[(2-bromo-4,5-dimethoxy-p…
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) | 1.69 | 4.13 | -42.51 | 3 | 5 | 1 | 64 | 346.245 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.69 | 2.88 | -11.63 | 2 | 5 | 0 | 60 | 345.237 | 7 | ↓ |