In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2010 | 25 | Yes |
Popular Name: 2-(3,4-dimethylphenoxy)-1-[4-(2-hydroxyphenyl)piperazin-1-yl]ethanone 2-(3,4-dimethylphenoxy)-1-[4-(2-…
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) | 3.49 | 8.3 | -14.1 | 1 | 5 | 0 | 53 | 340.423 | 4 | ↓ |
Popular Name: 1-[4-(2-hydroxyphenyl)piperazin-1-yl]-2-(4-isopropyl-3-methyl-phenoxy)ethanone 1-[4-(2-hydroxyphenyl)piperazin-…
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) | 4.08 | 8.31 | -15.43 | 1 | 5 | 0 | 53 | 368.477 | 5 | ↓ |
Popular Name: 1-[4-(2-hydroxyphenyl)piperazin-1-yl]-2-(2-methoxy-4-methyl-phenoxy)ethanone 1-[4-(2-hydroxyphenyl)piperazin-…
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) | 2.70 | 7.49 | -17.47 | 1 | 6 | 0 | 62 | 356.422 | 5 | ↓ |