| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 34 | Yes |
Popular Name: 4-[(3aR,9bS)-9-methoxy-3,3a,4,9b-tetrahydro-1H-chromeno[3,4-c]pyrrol-2-yl]butylBLAHdione 4-[(3aR,9bS)-9-methoxy-3,3a,4,9b…
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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) | 3.60 | 7.73 | -61.97 | 1 | 8 | 0 | 94 | 478.574 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.60 | 5.31 | -53.33 | 0 | 8 | -1 | 93 | 477.566 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 9.62 | -45.36 | 2 | 8 | 1 | 91 | 479.582 | 6 | ↓ |
