In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 20 | Yes |
Popular Name: N-[5-bromo-2-(ethylaminomethyl)phenyl]-N',N'-dimethyl-N-propyl-ethane-1,2-diamine N-[5-bromo-2-(ethylaminomethyl)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) | 3.62 | 10.68 | -106.31 | 3 | 3 | 2 | 24 | 344.341 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 8.21 | -40.21 | 2 | 3 | 1 | 23 | 343.333 | 9 | ↓ |