In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 16 | Yes |
Popular Name: 2-(cyclopropylamino)-1-(4-prop-2-ynylpiperazin-1-yl)ethanone 2-(cyclopropylamino)-1-(4-prop-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) | -0.13 | 3.42 | -41.42 | 2 | 4 | 1 | 40 | 222.312 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.13 | 2.14 | -9.24 | 1 | 4 | 0 | 36 | 221.304 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.13 | 5.66 | -98.11 | 3 | 4 | 2 | 41 | 223.32 | 4 | ↓ |