| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 15 | Yes |
Popular Name: (1R,2S)-1-(4-bromophenyl)-N1,N1-dimethyl-butane-1,2-diamine (1R,2S)-1-(4-bromophenyl)-N1,N1-…
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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) | 2.48 | 6.66 | -121.68 | 4 | 2 | 2 | 32 | 273.218 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.48 | 4.02 | -41.62 | 3 | 2 | 1 | 31 | 272.21 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 6.27 | -34.17 | 3 | 2 | 1 | 30 | 272.21 | 4 | ↓ |
