| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 29 | Yes |
Popular Name: 3-(3,3-diphenylpropylamino)-4-(4-methylpiperazin-1-yl)cyclobut-3-ene-1,2-dione 3-(3,3-diphenylpropylamino)-4-(4…
| 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) | -0.50 | 7.67 | -30.78 | 2 | 5 | 1 | 56 | 390.507 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.13 | 5.94 | -14.11 | 1 | 5 | 0 | 62 | 389.499 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.50 | 10.05 | -102.86 | 3 | 5 | 2 | 57 | 391.515 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 6.04 | -102.53 | 3 | 5 | 2 | 61 | 391.515 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 8.3 | -59.93 | 2 | 5 | 1 | 63 | 390.507 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
