In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 21 | Yes |
Popular Name: (R)-methyl 4-((2-butylpiperazin-1-yl)methyl) benzoate (R)-methyl 4-((2-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) | 3.14 | 9.13 | -130.98 | 3 | 4 | 2 | 47 | 292.423 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.14 | 5.66 | -5.68 | 1 | 4 | 0 | 42 | 290.407 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.14 | 7.02 | -46.14 | 2 | 4 | 1 | 46 | 291.415 | 7 | ↓ |