| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 23 | Yes |
Popular Name: (2S)-2-[[3-(4-ethylpiperazin-1-yl)-2,2-dimethyl-propanoyl]amino]-4-methyl-pentanoic (2S)-2-[[3-(4-ethylpiperazin-1-y…
| 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) | 0.63 | 6.89 | -57.73 | 2 | 6 | 0 | 77 | 327.469 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.63 | 4.58 | -59.42 | 1 | 6 | -1 | 76 | 326.461 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 6.2 | -60.25 | 2 | 6 | 0 | 77 | 327.469 | 8 | ↓ |
