In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 16 | Yes |
Popular Name: 2-[4-(difluoromethylsulfonyl)-1,4-diazepan-1-yl]ethanamine 2-[4-(difluoromethylsulfonyl)-1,…
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) | -0.76 | -1.82 | -52.18 | 3 | 5 | 1 | 68 | 258.314 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.76 | 0.12 | -134.1 | 4 | 5 | 2 | 69 | 259.322 | 4 | ↓ |