In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: (1R,2R)-1-(4-tert-butylpiperazin-1-yl)-1-phenyl-propan-2-amine (1R,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) | 2.21 | 5.6 | -98.61 | 4 | 3 | 2 | 35 | 277.456 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 4.43 | -40.44 | 3 | 3 | 1 | 34 | 276.448 | 4 | ↓ |