| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 21 | Yes |
Popular Name: N-methyl-4-[[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]amino]methyl]benzamide N-methyl-4-[[[(4S)-4,5,6,7-tetra…
| 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) | 1.78 | 7.23 | -53.47 | 3 | 3 | 1 | 46 | 301.435 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.78 | 6.15 | -10.66 | 2 | 3 | 0 | 41 | 300.427 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
