In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 17 | Yes |
Popular Name: [3,5-dimethyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-4-yl]methanamine [3,5-dimethyl-1-(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) | 0.65 | 5.36 | -93.95 | 4 | 4 | 2 | 50 | 238.379 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.65 | 4.95 | -37.96 | 3 | 4 | 1 | 48 | 237.371 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.