| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 21 | Yes |
Popular Name: (1R)-3-(4-tert-butylpiperazin-1-yl)-N-methyl-1-phenyl-propan-1-amine (1R)-3-(4-tert-butylpiperazin-1-…
| 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) | 2.15 | 6.91 | -37.26 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.15 | 7.93 | -87.2 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.15 | 5.79 | -39.24 | 2 | 3 | 1 | 23 | 290.475 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.15 | 8.04 | -115.34 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
