In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-1-(3-bromophenyl)-1-(1-piperidyl)butan-2-amine (1S,2R)-1-(3-bromophenyl)-1-(1-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) | 3.36 | 6.91 | -40.63 | 3 | 2 | 1 | 31 | 312.275 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.36 | 8.54 | -122.15 | 4 | 2 | 2 | 32 | 313.283 | 4 | ↓ |