In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 20 | Yes |
Popular Name: 3-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)pyrazine-2-carboxamide 3-(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) | 0.58 | 2.47 | -42.3 | 4 | 6 | 1 | 89 | 270.316 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.