In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-1-(4-tert-butylpiperazin-1-yl)-1-(4-fluorophenyl)propan-2-amine (1S,2R)-1-(4-tert-butylpiperazin…
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) | 2.37 | 6.72 | -103.29 | 4 | 3 | 2 | 35 | 295.446 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 4.58 | -42.89 | 3 | 3 | 1 | 34 | 294.438 | 4 | ↓ |