In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: 1-[2-(4-tert-butyl-2-methyl-phenoxy)ethyl]-4-methyl-piperazine 1-[2-(4-tert-butyl-2-methyl-phen…
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) | 4.00 | 8.8 | -35.2 | 1 | 3 | 1 | 17 | 291.459 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 8.73 | -34.27 | 1 | 3 | 1 | 17 | 291.459 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 6.34 | -3.88 | 0 | 3 | 0 | 16 | 290.451 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.