In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 17 | Yes |
Popular Name: [(3S)-1-(2,2,6,6-tetramethyl-4-piperidyl)pyrrolidin-3-yl]methanamine [(3S)-1-(2,2,6,6-tetramethyl-4-p…
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) | 1.44 | 2.48 | -84.08 | 5 | 3 | 2 | 47 | 241.423 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.44 | 4.9 | -176.92 | 6 | 3 | 3 | 49 | 242.431 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.