In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 18 | Yes |
Popular Name: N'-[(2-bromophenyl)methyl]-N,N-diisopropyl-ethane-1,2-diamine N'-[(2-bromophenyl)methyl]-N,N-d…
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) | 3.63 | 7.12 | -35.9 | 2 | 2 | 1 | 20 | 314.291 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.63 | 5.6 | -2.33 | 1 | 2 | 0 | 15 | 313.283 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 7.71 | -30.79 | 2 | 2 | 1 | 16 | 314.291 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 9.03 | -104.66 | 3 | 2 | 2 | 21 | 315.299 | 7 | ↓ |