| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 6th, 2010 | 21 | Yes |
Popular Name: 2-[4-(4-amino-1H-pyrrole-2-carbonyl)piperazin-1-yl]-N-propyl-acetamide 2-[4-(4-amino-1H-pyrrole-2-carbo…
| 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) | 0.32 | 0.29 | -15.93 | 4 | 7 | 0 | 94 | 293.371 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.12 | -0.9 | -59.75 | 4 | 7 | 1 | 93 | 294.379 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.32 | 2.44 | -51.56 | 5 | 7 | 1 | 96 | 294.379 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.12 | 1.24 | -103.93 | 5 | 7 | 2 | 94 | 295.387 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
