In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 16 | Yes |
Popular Name: N-[(1S,2S,4R)-2,4-dimethylcyclohexyl]-6-methyl-pyridazin-3-amine N-[(1S,2S,4R)-2,4-dimethylcycloh…
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) | 2.59 | 6.61 | -27.49 | 2 | 3 | 1 | 39 | 220.34 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 6.49 | -6.74 | 1 | 3 | 0 | 38 | 219.332 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 6.66 | -26.99 | 2 | 3 | 1 | 39 | 220.34 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.