In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2010 | 20 | Yes |
Popular Name: (2S)-1-tert-butoxy-3-[[(1R)-1-(4-chlorophenyl)ethyl]-methyl-amino]propan-2-ol (2S)-1-tert-butoxy-3-[[(1R)-1-(4…
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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) | 3.50 | 7.16 | -40.6 | 2 | 3 | 1 | 34 | 300.85 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.50 | 5.13 | -4.9 | 1 | 3 | 0 | 33 | 299.842 | 7 | ↓ |