| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 16 | Yes |
Popular Name: (3S,4R)-N3-[(1S)-1-cyclopropylethyl]-N4-ethyl-N3-methyl-tetrahydropyran-3,4-diamine (3S,4R)-N3-[(1S)-1-cyclopropylet…
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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) | 1.79 | 5.78 | -109.06 | 3 | 3 | 2 | 30 | 228.38 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.79 | 2.74 | -1.36 | 1 | 3 | 0 | 24 | 226.364 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.79 | 3.87 | -34.33 | 2 | 3 | 1 | 29 | 227.372 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 4.6 | -31.87 | 2 | 3 | 1 | 26 | 227.372 | 5 | ↓ |
