| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 21 | Yes |
Popular Name: (8R,9S)-N8-methyl-N8-(4-methylcyclohexyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulene-8,9-diamine (8R,9S)-N8-methyl-N8-(4-methylcy…
| 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) | 1.90 | 9.54 | -121.65 | 4 | 2 | 2 | 32 | 288.479 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.90 | 7.05 | -1.27 | 2 | 2 | 0 | 29 | 286.463 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.90 | 9.54 | -35.34 | 3 | 2 | 1 | 30 | 287.471 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
