| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 16 | Yes |
Popular Name: (2S,3S)-N2,N3-dimethyl-N2-[(1-methylpyrazol-4-yl)methyl]pentane-2,3-diamine (2S,3S)-N2,N3-dimethyl-N2-[(1-me…
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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) | 1.10 | 4 | -39.95 | 2 | 4 | 1 | 38 | 225.36 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 4.75 | -37.05 | 2 | 4 | 1 | 34 | 225.36 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.10 | 5.85 | -108.93 | 3 | 4 | 2 | 39 | 226.368 | 6 | ↓ |
