| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 16 | Yes |
Popular Name: (3S,4S)-N3-[(1R)-1,3-dimethylbutyl]-N3,N4-dimethyl-tetrahydropyran-3,4-diamine (3S,4S)-N3-[(1R)-1,3-dimethylbut…
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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) | 2.20 | 5.72 | -7.1 | 3 | 3 | 0 | 30 | 230.396 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 3.7 | -0.73 | 2 | 3 | 0 | 29 | 229.388 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 2.85 | -0.89 | 1 | 3 | 0 | 24 | 228.38 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 4.46 | -1.41 | 2 | 3 | 0 | 26 | 229.388 | 5 | ↓ |
