In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2009 | 21 | Yes |
Popular Name: 1H-Naphtho(2,1-b)pyran-1-one, 3-(diethylamino)-5-hydroxy-; BRN 1652945; K 12107; LS-95537 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) | 0.08 | 5.08 | -27.23 | 2 | 4 | 1 | 57 | 284.335 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.66 | 6.98 | -13.97 | 1 | 4 | 0 | 54 | 283.327 | 3 | ↓ |