In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2006 | 18 | Yes |
Popular Name: 2-(4-Fluorophenyl)-3-hydroxy-1,5,6,7-tetrahydro-4H-indol-4-one 2-(4-Fluorophenyl)-3-hydroxy-1,5…
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) | 2.67 | 4.71 | -14.21 | 2 | 3 | 0 | 53 | 245.253 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 4.34 | -15.3 | 0 | 3 | 0 | 52 | 244.245 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 5.48 | -62.92 | 1 | 3 | -1 | 56 | 244.245 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.