In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 27 | Yes |
Popular Name: 1-[[1-(4-chlorophenyl)-2-methyl-5-phenyl-pyrrol-3-yl]methyl]-4-methyl-piperazine 1-[[1-(4-chlorophenyl)-2-methyl-…
None
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) | 4.39 | 13.16 | -36.41 | 1 | 3 | 1 | 13 | 380.943 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 13.03 | -36.68 | 1 | 3 | 1 | 13 | 380.943 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 10.69 | -4.32 | 0 | 3 | 0 | 11 | 379.935 | 4 | ↓ |