| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 21 | No |
Popular Name: N-[3-(dimethylamino)propyl]-4-(3-thienylmethyl)piperazine-1-carbothioamide N-[3-(dimethylamino)propyl]-4-(3…
| 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) | 1.71 | 7.76 | -48.32 | 2 | 4 | 1 | 23 | 327.543 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 9.99 | -103.7 | 3 | 4 | 2 | 24 | 328.551 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
