In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 4-bromo-N-[4-(5-oxo-1,2-dihydropyrazol-3-yl)phenyl]-1H-pyrrole-2-carboxamide 4-bromo-N-[4-(5-oxo-1,2-dihydrop…
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) | 2.68 | 1.91 | -51.34 | 3 | 6 | -1 | 97 | 346.164 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.22 | 3.07 | -19.19 | 4 | 6 | 0 | 94 | 347.172 | 3 | ↓ |