| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 24 | Yes |
Popular Name: 2-propyl-N-[3-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]-pentanamide 2-propyl-N-[3-(4-thia-1,6-diazab…
| 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) | 4.85 | 10.73 | -21.75 | 1 | 4 | 0 | 47 | 343.496 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.85 | 10.85 | -35.48 | 2 | 4 | 1 | 48 | 344.504 | 7 | ↓ |
