| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 15 | Yes |
Popular Name: (5S,8R)-8-isopropyl-5-methyl-5,6,7,8-tetrahydrocinnolin-3-amine (5S,8R)-8-isopropyl-5-methyl-5,6…
| 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) | 2.40 | 5.1 | -24.04 | 3 | 3 | 1 | 53 | 206.313 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 5.02 | -7.22 | 2 | 3 | 0 | 52 | 205.305 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 5.17 | -26.55 | 3 | 3 | 1 | 53 | 206.313 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
