In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 19 | Yes |
Popular Name: 4-[5-[[cyclopropyl(isobutyl)amino]methyl]-3-thienyl]but-3-yn-1-ol 4-[5-[[cyclopropyl(isobutyl)amin…
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) | 2.90 | 8.66 | -35.31 | 2 | 2 | 1 | 25 | 278.441 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 6.62 | -4.39 | 1 | 2 | 0 | 23 | 277.433 | 6 | ↓ |