| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 17 | No |
Popular Name: N2,N2,2-trimethyl-N1-[[5-(methylsulfanylmethyl)-2-furyl]methyl]propane-1,2-diamine N2,N2,2-trimethyl-N1-[[5-(methyl…
| 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) | 2.33 | 5.77 | -38.28 | 2 | 3 | 1 | 33 | 257.423 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 4.62 | -4.15 | 1 | 3 | 0 | 28 | 256.415 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 6.57 | -32.47 | 2 | 3 | 1 | 30 | 257.423 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 7.88 | -113.54 | 3 | 3 | 2 | 34 | 258.431 | 7 | ↓ |
