In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 15 | Yes |
Popular Name: N-methyl-3-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]propan-1-amine N-methyl-3-[(3R)-3-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) | 0.95 | 4.54 | -80.14 | 3 | 3 | 2 | 24 | 213.369 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.95 | 2.13 | -36.58 | 2 | 3 | 1 | 23 | 212.361 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.95 | 7.01 | -182.64 | 4 | 3 | 3 | 25 | 214.377 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.