In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 20 | Yes |
Popular Name: 4H-1-Benzopyran-4-one, 6,8-diamino-7-hydroxy-2-phenyl- (9CI) 4H-1-Benzopyran-4-one, 6,8-diami…
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CAS Number: 848470-38-2
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) | 2.32 | 1.51 | -11.15 | 5 | 5 | 0 | 102 | 268.272 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 2.27 | -41.98 | 4 | 5 | -1 | 105 | 267.264 | 1 | ↓ |