| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 15 | Yes |
Popular Name: (2S,3R)-N2-methyl-N2-[(1R)-1-methylbutyl]-N3-propyl-butane-2,3-diamine (2S,3R)-N2-methyl-N2-[(1R)-1-met…
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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) | 3.43 | 6.37 | -34.23 | 2 | 2 | 1 | 20 | 215.405 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 5.45 | 0.2 | 1 | 2 | 0 | 15 | 214.397 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 6.76 | -28.57 | 2 | 2 | 1 | 16 | 215.405 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 7.82 | -101.99 | 3 | 2 | 2 | 21 | 216.413 | 8 | ↓ |
