In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 20 | Yes |
Popular Name: 2-(3-aminophenyl)-1-(4-tert-butylpiperazin-1-yl)ethanone 2-(3-aminophenyl)-1-(4-tert-buty…
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) | 1.60 | 6.52 | -42.37 | 3 | 4 | 1 | 51 | 276.404 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.60 | 4.46 | -9.1 | 2 | 4 | 0 | 50 | 275.396 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.