In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 15 | Yes |
Popular Name: (2S)-1-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]butan-2-ol (2S)-1-[(4aS,8aS)-2,3,4a,5,6,7,8…
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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) | 1.81 | 3.62 | -33.11 | 2 | 3 | 1 | 34 | 214.329 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.81 | 1.33 | -3.56 | 1 | 3 | 0 | 33 | 213.321 | 3 | ↓ |