In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2010 | 15 | Yes |
Popular Name: (2R,3aR,7aS)-2-(5-methyl-1H-1,2,4-triazol-3-yl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole (2R,3aR,7aS)-2-(5-methyl-1H-1,2,…
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) | 1.23 | 4.33 | -32.67 | 3 | 4 | 1 | 58 | 207.301 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.