In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 19 | Yes |
Popular Name: N-[2-(aminomethyl)-5-bromo-phenyl]-N-isobutyl-N',N'-dimethyl-ethane-1,2-diamine N-[2-(aminomethyl)-5-bromo-pheny…
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) | 3.11 | 8.43 | -113.67 | 4 | 3 | 2 | 35 | 330.314 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.11 | 6.01 | -47.98 | 3 | 3 | 1 | 34 | 329.306 | 7 | ↓ |