In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 20 | Yes |
Popular Name: 3-[(2S)-2-(dimethylaminomethyl)morpholin-4-yl]-5,6-dimethyl-pyridazine-4-carbonitrile 3-[(2S)-2-(dimethylaminomethyl)m…
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) | 0.99 | 6.47 | -36.29 | 1 | 6 | 1 | 66 | 276.364 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.99 | 3.94 | -8.24 | 0 | 6 | 0 | 65 | 275.356 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.