In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 14 | Yes |
Popular Name: N-methyl-5,6,7,8,9,10-hexahydrocycloocta[c]pyridazin-3-amine N-methyl-5,6,7,8,9,10-hexahydroc…
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) | 2.79 | 4.83 | -24.97 | 2 | 3 | 1 | 39 | 192.286 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 4.7 | -8.46 | 1 | 3 | 0 | 38 | 191.278 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 4.86 | -25.29 | 2 | 3 | 1 | 39 | 192.286 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.