| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 13 | Yes |
Popular Name: (2S,3R)-N2-(1-ethylpropyl)-N2,N3-dimethyl-butane-2,3-diamine (2S,3R)-N2-(1-ethylpropyl)-N2,N3…
| 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) | 2.53 | 5.94 | -100.05 | 3 | 2 | 2 | 21 | 188.359 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.53 | 4.84 | -28.35 | 2 | 2 | 1 | 16 | 187.351 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.53 | 4.01 | -34.63 | 2 | 2 | 1 | 20 | 187.351 | 6 | ↓ |
