In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 26 | Yes |
Popular Name: (2-hydroxyphenyl)-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]methanone (2-hydroxyphenyl)-[4-(p-tolylsul…
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) | 2.91 | 4.98 | -18.24 | 1 | 6 | 0 | 78 | 374.462 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.91 | 5.76 | -65.6 | 0 | 6 | -1 | 81 | 373.454 | 3 | ↓ |