In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 19 | Yes |
Popular Name: (1S,2R)-1-(4-bromophenyl)-1-(4-methoxy-1-piperidyl)propan-2-amine (1S,2R)-1-(4-bromophenyl)-1-(4-m…
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) | 1.58 | 6.73 | -127.43 | 4 | 3 | 2 | 41 | 329.282 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.58 | 6.41 | -38.24 | 3 | 3 | 1 | 40 | 328.274 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 4.16 | -45.95 | 3 | 3 | 1 | 40 | 328.274 | 4 | ↓ |