In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 14 | Yes |
Popular Name: (3S)-1-methyl-3-[(2R,4S)-4-methyl-2-piperidyl]pyrrolidin-3-ol (3S)-1-methyl-3-[(2R,4S)-4-methy…
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) | 0.82 | 2.78 | -97.38 | 4 | 3 | 2 | 41 | 200.326 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.82 | 0.17 | -34.39 | 3 | 3 | 1 | 40 | 199.318 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.