In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: 2-(cyclopropylamino)-1-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone 2-(cyclopropylamino)-1-[(2R)-2-(…
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) | 2.03 | 8.55 | -39.57 | 2 | 4 | 1 | 42 | 276.404 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.03 | 7.26 | -8.44 | 1 | 4 | 0 | 37 | 275.396 | 4 | ↓ |