| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 12 | Yes |
Popular Name: (2S)-N1-[[(2R)-tetrahydropyran-2-yl]methyl]propane-1,2-diamine (2S)-N1-[[(2R)-tetrahydropyran-2…
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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) | -0.17 | 1.78 | -116.68 | 5 | 3 | 2 | 53 | 174.288 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.17 | 1.43 | -35.7 | 4 | 3 | 1 | 52 | 173.28 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.17 | 0.43 | -36.63 | 4 | 3 | 1 | 49 | 173.28 | 4 | ↓ |
