In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 15 | Yes |
Popular Name: (2Z)-5-chloro-2-[hydroxy(methoxy)methylene]benzothiophen-3-one (2Z)-5-chloro-2-[hydroxy(methoxy…
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) | 3.34 | 5.91 | -49.13 | 0 | 3 | -1 | 49 | 241.675 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.34 | 4.96 | -7.58 | 1 | 3 | 0 | 47 | 242.683 | 2 | ↓ |