In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2010 | 23 | Yes |
Popular Name: 2-[4-(4-bromo-1H-pyrrole-2-carbonyl)piperazin-1-yl]-1-(1-piperidyl)ethanone 2-[4-(4-bromo-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) | 1.42 | 5.38 | -15.74 | 1 | 6 | 0 | 60 | 383.29 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 7.52 | -54.01 | 2 | 6 | 1 | 61 | 384.298 | 3 | ↓ |