In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | Yes |
Popular Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(3,5-dimethyl-1H-pyrazol-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) | 1.40 | 7.62 | -113.58 | 4 | 4 | 2 | 50 | 274.412 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 4.39 | -5.87 | 2 | 4 | 0 | 44 | 272.396 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 6.49 | -38.64 | 3 | 4 | 1 | 45 | 273.404 | 6 | ↓ |