| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2007 | 29 | Yes |
Popular Name: 4-butoxy-N-[4-(4-thia-1,6-diazabicyclo[3.3.0]octa-5,7-dien-7-yl)phenyl]-benzenesulfonamide 4-butoxy-N-[4-(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) | 4.71 | -4.74 | -18.94 | 1 | 6 | 0 | 73 | 429.567 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.71 | -4.16 | -53.64 | 0 | 6 | -1 | 75 | 428.559 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.71 | -3.91 | -53.88 | 1 | 6 | 0 | 76 | 429.567 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.71 | -4.49 | -38.73 | 2 | 6 | 1 | 74 | 430.575 | 8 | ↓ |
