In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2005 | 29 | Yes |
Popular Name: 2-(6-hexyl-7-hydroxy-2-imino-chromen-3-yl)-3H-quinazolin-4-one 2-(6-hexyl-7-hydroxy-2-imino-chr…
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) | 4.77 | 7.11 | -38.2 | 4 | 6 | 1 | 105 | 390.463 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.23 | 6.24 | -36.13 | 3 | 6 | 0 | 108 | 389.455 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.77 | -3.85 | -16.51 | 3 | 6 | 0 | 102 | 389.455 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.23 | -4.57 | -17.8 | 3 | 6 | 0 | 103 | 389.455 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.