In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 14th, 2011 | 26 | Yes |
Popular Name: 5-BROMO-4-CHLORO-3-INDOLYL-N-ACETYL-b-D-GLUCOSAMINIDE; [4264-82-8] 5-BROMO-4-CHLORO-3-INDOLYL-N-ACE…
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) | 0.13 | -1.3 | -39.06 | 4 | 8 | -1 | 127 | 448.677 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.13 | -1.76 | -12.95 | 5 | 8 | 0 | 124 | 449.685 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 240 °C(lit.) | Indofine |
No pre-computed analogs available. Try a structural similarity search.