In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 29 | Yes |
Popular Name: 2-[4-[[1-methyl-3-(4-phenoxyphenyl)pyrazol-4-yl]methyl]piperazin-1-yl]ethanol 2-[4-[[1-methyl-3-(4-phenoxyphen…
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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) | 2.81 | 7.21 | -41.13 | 2 | 6 | 1 | 55 | 393.511 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.81 | 7.39 | -37.57 | 2 | 6 | 1 | 55 | 393.511 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.81 | 5.04 | -10.68 | 1 | 6 | 0 | 54 | 392.503 | 7 | ↓ |