| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2011 | 19 | Yes |
Popular Name: (1-methyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl)-[(2S)-tetrahydrofuran-2-yl]methanone (1-methyl-3,5-dihydro-2H-1,4-ben…
| 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) | 1.35 | 7.47 | -12.88 | 0 | 4 | 0 | 33 | 260.337 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.35 | 7.47 | -49.57 | 1 | 4 | 1 | 34 | 261.345 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
