| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 17 | Yes |
Popular Name: (2S)-2-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]propanamidine (2S)-2-[4-(pyrrolidin-1-ylmethyl…
| 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) | 0.97 | 4.07 | -76.75 | 5 | 4 | 2 | 59 | 240.395 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.97 | 6 | -179.84 | 6 | 4 | 3 | 60 | 241.403 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
