In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 21 | No |
Popular Name: (7aS)-3-[(E)-(2-pyridylhydrazono)methyl]-7aH-indole-7-carboxylic (7aS)-3-[(E)-(2-pyridylhydrazono…
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) | 0.93 | 4.52 | -68.91 | 1 | 6 | -1 | 90 | 279.279 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.93 | 4.96 | -84.57 | 2 | 6 | 0 | 91 | 280.287 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.