In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 29 | No |
Popular Name: 2-[[4-(4-ethylpiperazine-1-carbonyl)phenyl]methylsulfanyl]-N-(4-fluorophenyl)acetamide 2-[[4-(4-ethylpiperazine-1-carbo…
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) | 2.63 | 11.04 | -54.01 | 2 | 5 | 1 | 54 | 416.542 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 8.81 | -18.78 | 1 | 5 | 0 | 53 | 415.534 | 7 | ↓ |