In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 26 | Yes |
Popular Name: N2-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]thiophene-2,4-dicarboxamide N2-[4-(4-ethylpiperazin-1-yl)-2-…
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) | 2.22 | 6.01 | -52.43 | 4 | 6 | 1 | 80 | 373.502 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 3.79 | -20.25 | 3 | 6 | 0 | 79 | 372.494 | 5 | ↓ |