In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 20 | Yes |
Popular Name: 3-(4-tert-butylpiperazin-1-yl)-1-phenyl-propan-1-one 3-(4-tert-butylpiperazin-1-yl)-1…
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) | 2.84 | 7.88 | -35.72 | 1 | 3 | 1 | 25 | 275.416 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 5.75 | -6.41 | 0 | 3 | 0 | 24 | 274.408 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.