In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 21 | Yes |
Popular Name: [5,6-dimethyl-3-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)pyridazin-4-yl]methanamine [5,6-dimethyl-3-(1,3,4,5-tetrahy…
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) | 2.47 | 7.32 | -61.16 | 3 | 4 | 1 | 57 | 283.399 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 6.95 | -9.5 | 2 | 4 | 0 | 55 | 282.391 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.