| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | No |
Popular Name: 1-(2-diethylaminoethyl)-N-[(3R)-1,1-dioxothian-3-yl]pyrazol-4-amine 1-(2-diethylaminoethyl)-N-[(3R)-…
| 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) | 1.41 | 4.08 | -45.8 | 2 | 6 | 1 | 68 | 315.463 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.41 | 1.96 | -14.05 | 1 | 6 | 0 | 67 | 314.455 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
