In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: 3-(cyclopropylamino)-1-(4-prop-2-ynylpiperazin-1-yl)propan-1-one 3-(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) | 0.14 | 4.05 | -45.34 | 2 | 4 | 1 | 40 | 236.339 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.14 | 6.29 | -98.46 | 3 | 4 | 2 | 41 | 237.347 | 5 | ↓ |