In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(1,3,5-trimethylpyrazol-4-yl)methanamine N-[[2-(dimethylaminomethyl)pheny…
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) | 1.47 | 9.11 | -120.6 | 3 | 4 | 2 | 39 | 288.439 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 7.87 | -39.29 | 2 | 4 | 1 | 34 | 287.431 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.