In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2011 | 19 | Yes |
Popular Name: [4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]-(1-methylpyrazol-4-yl)methanone [4-(2-hydroxy-2-methyl-propyl)pi…
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) | -0.65 | 1.57 | -10.3 | 1 | 6 | 0 | 62 | 266.345 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.65 | 3.29 | -44.88 | 2 | 6 | 1 | 63 | 267.353 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.