In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: 2-(3-amino-4-bromo-pyrazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 2-(3-amino-4-bromo-pyrazol-1-yl)…
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) | 2.11 | 6.72 | -10.07 | 2 | 5 | 0 | 81 | 304.151 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.11 | 6.45 | -38.01 | 3 | 5 | 1 | 82 | 305.159 | 1 | ↓ |