| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 16 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[(5-iodo-2-furyl)methyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[(5-iodo-2…
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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) | 3.07 | 6.01 | -36.58 | 2 | 3 | 1 | 33 | 337.225 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 4.92 | -1.89 | 1 | 3 | 0 | 28 | 336.217 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 6.81 | -32.98 | 2 | 3 | 1 | 30 | 337.225 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 8.1 | -112.77 | 3 | 3 | 2 | 34 | 338.233 | 7 | ↓ |
