| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 16 | Yes |
Popular Name: (3S)-1-[(1S)-1-methylhexyl]-N-propyl-pyrrolidin-3-amine (3S)-1-[(1S)-1-methylhexyl]-N-pr…
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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) | 3.90 | 7.59 | -30.78 | 2 | 2 | 1 | 16 | 227.416 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.90 | 5.44 | -0.53 | 1 | 2 | 0 | 15 | 226.408 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.90 | 6.64 | -35.4 | 2 | 2 | 1 | 20 | 227.416 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.90 | 8.79 | -108.02 | 3 | 2 | 2 | 21 | 228.424 | 8 | ↓ |
