In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 19 | Yes |
Popular Name: 1-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)-2-(tetrazol-1-yl)ethanone 1-(2,3,4,5-tetrahydro-1,4-benzod…
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) | -0.26 | 4.93 | -56.61 | 2 | 7 | 1 | 81 | 259.293 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.26 | 3.68 | -17.96 | 1 | 7 | 0 | 76 | 258.285 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.