| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 18 | Yes |
Popular Name: (2S)-1,1,1-trifluoro-3-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)propan-2-ol (2S)-1,1,1-trifluoro-3-(2,3,4,5-…
| 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) | 1.69 | 3.74 | -40.83 | 3 | 3 | 1 | 40 | 261.267 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.69 | 2.5 | -4.06 | 2 | 3 | 0 | 35 | 260.259 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
