In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 24 | Yes |
Popular Name: (2S)-1-(4-methyl-1-piperidyl)-3-[4-(m-tolyl)piperazin-1-yl]propan-2-ol (2S)-1-(4-methyl-1-piperidyl)-3-…
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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) | 2.89 | 7.22 | -38.15 | 2 | 4 | 1 | 31 | 332.512 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.89 | 9.49 | -109.27 | 3 | 4 | 2 | 32 | 333.52 | 5 | ↓ |