In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 14 | Yes |
Popular Name: [(1R,3S)-3-methyl-1-pyrrolidin-1-yl-cyclohexyl]methanamine [(1R,3S)-3-methyl-1-pyrrolidin-1…
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) | 1.53 | 5.29 | -120.71 | 4 | 2 | 2 | 32 | 198.354 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 3.24 | -41.75 | 3 | 2 | 1 | 31 | 197.346 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.