| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 19 | Yes |
Popular Name: N-methyl-1-[3-[[(2S)-2-methylpyrrolidin-1-yl]methyl]benzothiophen-2-yl]methanamine N-methyl-1-[3-[[(2S)-2-methylpyr…
| 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) | 3.17 | 9.23 | -108.84 | 3 | 2 | 2 | 21 | 276.449 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 7.76 | -33.4 | 2 | 2 | 1 | 16 | 275.441 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
