In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 24 | Yes |
Popular Name: (2R)-2-(2-fluorophenyl)-1-methyl-4-(p-tolylsulfonyl)piperazine (2R)-2-(2-fluorophenyl)-1-methyl…
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 | 6.89 | -10.14 | 0 | 4 | 0 | 41 | 348.443 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 8.38 | -46.67 | 1 | 4 | 1 | 42 | 349.451 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.