In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: 4-[[[(1S)-1-(2-bromophenyl)ethyl]amino]methyl]-2-methoxy-phenol 4-[[[(1S)-1-(2-bromophenyl)ethyl…
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) | 3.55 | 6.55 | -46.43 | 3 | 3 | 1 | 46 | 337.237 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.55 | 5.38 | -6.13 | 2 | 3 | 0 | 41 | 336.229 | 5 | ↓ |