| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 21 | Yes |
Popular Name: 5-methyl-3-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-ylsulfonylmethyl)isoxazole 5-methyl-3-(2,3,4,5-tetrahydro-1…
| 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) | 1.33 | 3.62 | -52.23 | 2 | 6 | 1 | 80 | 308.383 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 2.38 | -16.57 | 1 | 6 | 0 | 75 | 307.375 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
