In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | No |
Popular Name: 5,6-dimethyl-3-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]pyridazine-4-carboxamidine 5,6-dimethyl-3-[methyl-[[(2S)-te…
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) | 0.14 | 3 | -9.61 | 3 | 6 | 0 | 88 | 263.345 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 2.98 | -41.87 | 4 | 6 | 1 | 90 | 264.353 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.14 | 3.1 | -91.64 | 5 | 6 | 2 | 91 | 265.361 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.14 | 3.11 | -29.27 | 4 | 6 | 1 | 89 | 264.353 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.