In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 30 | Yes |
Popular Name: 7-[2-(4-methylpiperazin-1-yl)ethoxy]-2-morpholino-8-propyl-chromen-4-one 7-[2-(4-methylpiperazin-1-yl)eth…
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) | -0.51 | 6.16 | -71.17 | 2 | 7 | 2 | 63 | 417.55 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.08 | 5.61 | -10.96 | 0 | 7 | 0 | 58 | 415.534 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 7.98 | -44.8 | 1 | 7 | 1 | 60 | 416.542 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.51 | 6.06 | -78.97 | 2 | 7 | 2 | 63 | 417.55 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.51 | 3.81 | -28.89 | 1 | 7 | 1 | 61 | 416.542 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.