In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 18 | Yes |
Popular Name: [1-[[(3S)-1-ethyl-3-methyl-3-piperidyl]methyl]-4-piperidyl]methanol [1-[[(3S)-1-ethyl-3-methyl-3-pip…
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) | 1.91 | 6.11 | -96.04 | 3 | 3 | 2 | 29 | 256.434 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.91 | 4.19 | -38.05 | 2 | 3 | 1 | 28 | 255.426 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.91 | 3.76 | -34.99 | 2 | 3 | 1 | 28 | 255.426 | 4 | ↓ |