In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 25 | Yes |
Popular Name: (3S)-1-(1-isopropyl-4-piperidyl)-N-[(5-methyl-2-thienyl)methyl]piperidine-3-carboxamide (3S)-1-(1-isopropyl-4-piperidyl)…
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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) | 2.83 | 8.14 | -39.81 | 2 | 4 | 1 | 37 | 364.579 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.83 | 10.65 | -101.47 | 3 | 4 | 2 | 38 | 365.587 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.83 | 8.15 | -37.12 | 2 | 4 | 1 | 37 | 364.579 | 5 | ↓ |