In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 34 | Yes |
Popular Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1,4-dimethyl-2,3-dioxo-quinoxaline-6-sulfonamide N-[3-(4-benzylpiperazin-1-yl)pro…
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) | 1.40 | 7.04 | -63.1 | 2 | 9 | 1 | 98 | 486.618 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 7.1 | -56.59 | 2 | 9 | 1 | 98 | 486.618 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 4.72 | -20.35 | 1 | 9 | 0 | 97 | 485.61 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.