In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 20 | Yes |
Popular Name: (1R)-N-benzyl-1-(3-bromophenyl)-N-ethyl-ethane-1,2-diamine (1R)-N-benzyl-1-(3-bromophenyl)-…
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) | 3.29 | 7.36 | -53.3 | 3 | 2 | 1 | 31 | 334.281 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 9.21 | -134.33 | 4 | 2 | 2 | 32 | 335.289 | 6 | ↓ |