In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 30 | Yes |
Popular Name: 4-(6-chloro-2-oxo-chromen-3-yl)-7-hydroxy-8-(pyrrolidin-1-ylmethyl)chromen-2-one 4-(6-chloro-2-oxo-chromen-3-yl)-…
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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) | 4.49 | 11.69 | -38.68 | 2 | 6 | 1 | 85 | 424.86 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.49 | 12.46 | -27.17 | 1 | 6 | 0 | 88 | 423.852 | 3 | ↓ |