In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 21 | Yes |
Popular Name: 6-[(isobutylamino)methyl]-N-methyl-N-[(2-methylthiazol-4-yl)methyl]pyridazin-3-amine 6-[(isobutylamino)methyl]-N-meth…
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) | 1.66 | 6.9 | -46.22 | 2 | 5 | 1 | 59 | 306.459 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.66 | 5.52 | -11.27 | 1 | 5 | 0 | 54 | 305.451 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.66 | 7.16 | -100.58 | 3 | 5 | 2 | 60 | 307.467 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.