In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 18 | Yes |
Popular Name: (2R)-2-(4-bromophenyl)-2-(4-methyl-1,4-diazepan-1-yl)ethanamine (2R)-2-(4-bromophenyl)-2-(4-meth…
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) | 1.70 | 5.72 | -114.86 | 4 | 3 | 2 | 35 | 314.271 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 3.58 | -51.68 | 3 | 3 | 1 | 34 | 313.263 | 3 | ↓ |