| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 6th, 2010 | 21 | Yes |
Popular Name: 3,4-dimethyl-2-(4-prop-2-ynylpiperazin-1-yl)sulfonyl-aniline 3,4-dimethyl-2-(4-prop-2-ynylpip…
| 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) | 1.54 | 2.94 | -8.96 | 2 | 5 | 0 | 67 | 307.419 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.54 | 5.19 | -44.6 | 3 | 5 | 1 | 68 | 308.427 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
