In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 16 | Yes |
Popular Name: 2-[(5-amino-1,3-dimethyl-pyrazol-4-yl)methyl]pyridazin-3-one 2-[(5-amino-1,3-dimethyl-pyrazol…
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) | -0.06 | 3.08 | -29.03 | 3 | 6 | 1 | 80 | 220.256 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.06 | 2.95 | -11.17 | 2 | 6 | 0 | 79 | 219.248 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.