In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: 2-[[[(1S)-1-(3-bromo-4-methoxy-phenyl)ethyl]amino]methyl]phenol 2-[[[(1S)-1-(3-bromo-4-methoxy-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) | 4.19 | 6.06 | -43.53 | 3 | 3 | 1 | 46 | 337.237 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.19 | 4.92 | -5.76 | 2 | 3 | 0 | 41 | 336.229 | 5 | ↓ |