In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2009 | 22 | Yes |
Popular Name: 1H-Naphtho(2,1-b)pyran-1-one, 3-(diethylamino)-9-methoxy-; BRN 1650519; K 8406; LS-95540 1H-Naphtho(2,1-b)pyran-1-one, 3-…
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) | 0.40 | 6.59 | -26.99 | 1 | 4 | 1 | 46 | 298.362 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 8.5 | -18.82 | 0 | 4 | 0 | 43 | 297.354 | 4 | ↓ |