In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 23 | Yes |
Popular Name: (2R)-6-(4-ethylpiperazin-1-yl)sulfonyl-2-methyl-4H-1,4-benzoxazin-3-one (2R)-6-(4-ethylpiperazin-1-yl)su…
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) | 0.91 | 0.75 | -10.57 | 1 | 7 | 0 | 79 | 339.417 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.91 | 2.99 | -49.2 | 2 | 7 | 1 | 80 | 340.425 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.