In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 20 | Yes |
Popular Name: 4-bromo-N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-methyl-pyrrole-2-carboxamide 4-bromo-N-[2-(4-ethylpiperazin-1…
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) | 1.39 | 5.06 | -38.11 | 2 | 5 | 1 | 42 | 344.277 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 2.78 | -7.23 | 1 | 5 | 0 | 41 | 343.269 | 5 | ↓ |