| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2011 | 24 | Yes |
Popular Name: (3R)-4-[(2S)-3-[(1S)-1-(4-chlorophenyl)ethoxy]-2-hydroxy-propyl]-3-isopropyl-piperazin-2-one (3R)-4-[(2S)-3-[(1S)-1-(4-chloro…
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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) | 2.40 | 5.35 | -46.86 | 3 | 5 | 1 | 63 | 355.886 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 3.38 | -9.61 | 2 | 5 | 0 | 62 | 354.878 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
