In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 16 | Yes |
Popular Name: N1-(3-imidazol-1-ylpropyl)-N2,N2,2-trimethyl-propane-1,2-diamine N1-(3-imidazol-1-ylpropyl)-N2,N2…
None
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) | 0.54 | 5.89 | -46.45 | 2 | 4 | 1 | 38 | 225.36 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.54 | 4.74 | -6.27 | 1 | 4 | 0 | 33 | 224.352 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.54 | 6.85 | -37.95 | 2 | 4 | 1 | 34 | 225.36 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 7.37 | -75.87 | 3 | 4 | 2 | 36 | 226.368 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 6.41 | -92.63 | 3 | 4 | 2 | 39 | 226.368 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 8.01 | -121.72 | 3 | 4 | 2 | 39 | 226.368 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 8.52 | -181.83 | 4 | 4 | 3 | 40 | 227.376 | 7 | ↓ |