In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 28 | Yes |
Popular Name: 1-[[1,5-bis(2-fluorophenyl)-2-methyl-pyrrol-3-yl]methyl]-4-methyl-piperazine 1-[[1,5-bis(2-fluorophenyl)-2-me…
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) | 4.16 | 12.55 | -38.62 | 1 | 3 | 1 | 13 | 382.478 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.16 | 10.19 | -9.99 | 0 | 3 | 0 | 11 | 381.47 | 4 | ↓ |