In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2010 | 29 | Yes |
Popular Name: N-(2-pyridylmethyl)-4-[(2,3,5-trimethylpyrazolo[4,3-d]pyrimidin-7-yl)amino]benzamide N-(2-pyridylmethyl)-4-[(2,3,5-tr…
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) | 1.93 | 7.52 | -17.19 | 2 | 8 | 0 | 98 | 387.447 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 7.93 | -45.94 | 3 | 8 | 1 | 99 | 388.455 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.