In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: (3R)-1-[3-(cyclohexylamino)propyl]-N,N-diethyl-pyrrolidin-3-amine (3R)-1-[3-(cyclohexylamino)propy…
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) | 3.21 | 7.57 | -81.66 | 3 | 3 | 2 | 24 | 283.504 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 5.43 | -37.29 | 2 | 3 | 1 | 23 | 282.496 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.21 | 10 | -190.96 | 4 | 3 | 3 | 25 | 284.512 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.