In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 17 | Yes |
Popular Name: N-[(1S)-1-(2,6-dichloro-3-fluoro-phenyl)ethyl]-N',N'-dimethyl-ethane-1,2-diamine N-[(1S)-1-(2,6-dichloro-3-fluoro…
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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) | 3.46 | 7.52 | -34.59 | 2 | 2 | 1 | 16 | 280.194 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 5.62 | -30.63 | 2 | 2 | 1 | 20 | 280.194 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 5.05 | -2.47 | 1 | 2 | 0 | 15 | 279.186 | 5 | ↓ |