| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 19 | No |
Popular Name: (3S)-N,N-dimethyl-8-nitro-2,3,4,9-tetrahydro-1H-carbazol-3-amine (3S)-N,N-dimethyl-8-nitro-2,3,4,…
| 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) | 2.75 | 8.75 | -48.97 | 2 | 5 | 1 | 66 | 260.317 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.75 | 8.39 | -56.03 | 1 | 5 | 0 | 64 | 259.309 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.75 | 6.34 | -7.9 | 1 | 5 | 0 | 65 | 259.309 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US3959309; US4062864; US4172834; US4257952 | IBM Patent Data |
