| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 21 | Yes |
Popular Name: (4S)-N-[[3-(trifluoromethyl)phenyl]methyl]-4,5,6,7-tetrahydrobenzothiophen-4-amine (4S)-N-[[3-(trifluoromethyl)phen…
| 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) | 3.46 | 9.94 | -46.53 | 2 | 1 | 1 | 17 | 312.38 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 8.86 | -4.76 | 1 | 1 | 0 | 12 | 311.372 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
