| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2007 | 20 | Yes |
Popular Name: 3-(4-methylpiperazin-1-yl)-8-propyl-2,4,8-triazabicyclo[4.4.0]deca-1,3,5-triene 3-(4-methylpiperazin-1-yl)-8-pro…
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| 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) | 1.81 | 10.59 | -84.35 | 2 | 5 | 2 | 38 | 277.416 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 5.95 | -5.71 | 0 | 5 | 0 | 35 | 275.4 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 8.22 | -41.46 | 1 | 5 | 1 | 37 | 276.408 | 3 | ↓ |
