In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 17 | Yes |
Popular Name: 3-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]propanamidine 3-[4-(pyrrolidin-1-ylmethyl)-1-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) | 0.91 | 6.14 | -174.02 | 6 | 4 | 3 | 60 | 241.403 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.91 | 3.9 | -76.78 | 5 | 4 | 2 | 59 | 240.395 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.