In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 23 | Yes |
Popular Name: 3-[(R)-[[butyl(methyl)sulfamoyl]amino]-phenyl-methyl]-5-methyl-1H-1,2,4-triazole 3-[(R)-[[butyl(methyl)sulfamoyl]…
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) | 1.74 | 4.55 | -14.42 | 2 | 7 | 0 | 91 | 337.449 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 4.45 | -51.68 | 1 | 7 | -1 | 93 | 336.441 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.