| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 18 | Yes |
Popular Name: 4-{[3-(4-methylpiperazin-1-yl)propyl]amino}-4-oxobutanoic acid 4-{[3-(4-methylpiperazin-1-yl)pr…
| 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) | -0.60 | 3.5 | -69.7 | 2 | 6 | 0 | 77 | 257.334 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.60 | 1.13 | -45.91 | 1 | 6 | -1 | 76 | 256.326 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.60 | 3.4 | -69.36 | 2 | 6 | 0 | 77 | 257.334 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -0.60 | 1.53 | -41.23 | 3 | 6 | 1 | 74 | 258.342 | 7 | ↓ |
