| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 26 | Yes |
Popular Name: (3S)-3-methyl-7-(4-propylpiperazin-1-yl)sulfonyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione (3S)-3-methyl-7-(4-propylpiperaz…
| 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) | 0.91 | 0.37 | -14.58 | 2 | 8 | 0 | 99 | 380.47 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 2.6 | -56.66 | 3 | 8 | 1 | 100 | 381.478 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
