In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 15 | Yes |
Popular Name: (3S)-3-ethyl-3-[[(3S)-3-methylpyrrolidin-1-yl]methyl]piperidine (3S)-3-ethyl-3-[[(3S)-3-methylpy…
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) | 2.01 | 6.82 | -93.14 | 3 | 2 | 2 | 21 | 212.381 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 5.61 | -31.53 | 2 | 2 | 1 | 16 | 211.373 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 4.9 | -36.26 | 2 | 2 | 1 | 20 | 211.373 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.