| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2005 | 35 | Yes |
Popular Name: 3-(6-hydroxy-3-oxo-3H-xanthen-9-yl)-1-phenyl-2-naphthoic acid; nsc12181 3-(6-hydroxy-3-oxo-3H-xanthen-9-…
| 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) | 6.80 | 13.28 | -59.97 | 1 | 5 | -1 | 91 | 457.461 | 3 | ↓ |
| Hi High (pH 8-9.5) | 6.80 | 13.16 | -107.52 | 0 | 5 | -2 | 93 | 456.453 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_SUBSTANCE_COMMENT | pending | PDSP via PubChem |
