In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 17 | No |
Popular Name: (3R)-3-methyl-N-[[(3S)-3-methyl-3-piperidyl]methyl]-1,1-dioxo-thiolan-3-amine (3R)-3-methyl-N-[[(3S)-3-methyl-…
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) | 0.52 | 0.98 | -49.5 | 3 | 4 | 1 | 63 | 261.411 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.52 | 1.98 | -120.04 | 4 | 4 | 2 | 67 | 262.419 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.