In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 24 | Yes |
Popular Name: 1-cyclopentyl-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine 1-cyclopentyl-4-[(3,4,5-trimetho…
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) | 2.66 | 7.44 | -40.92 | 1 | 5 | 1 | 35 | 335.468 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.66 | 5.22 | -7.19 | 0 | 5 | 0 | 34 | 334.46 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 7.61 | -46.07 | 1 | 5 | 1 | 35 | 335.468 | 6 | ↓ |