In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-1-(4-bromophenyl)-1-[(2R)-2-methyl-1-piperidyl]propan-2-amine (1S,2R)-1-(4-bromophenyl)-1-[(2R…
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) | 3.18 | 5.62 | -45.07 | 3 | 2 | 1 | 31 | 312.275 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 7.08 | -32.28 | 3 | 2 | 1 | 30 | 312.275 | 3 | ↓ |