| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 21 | Yes |
Popular Name: 2,4-dichloro-6-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-ylmethyl)phenol 2,4-dichloro-6-(2,3,4,5-tetrahyd…
| 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) | 3.80 | 6.93 | -36.01 | 3 | 3 | 1 | 40 | 324.231 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.80 | 6.42 | -31.7 | 1 | 3 | -1 | 38 | 322.215 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.80 | 7.7 | -29.78 | 2 | 3 | 0 | 43 | 323.223 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
