In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 29 | Yes |
Popular Name: [(2R)-3-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-isobutyl-amino]-2-hydroxy-propyl] [(2R)-3-[[1-[(4-fluorophenyl)met…
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) | 4.19 | 11.94 | -46.53 | 2 | 5 | 1 | 56 | 405.534 | 13 | ↓ |
Hi High (pH 8-9.5) | 4.19 | 11.11 | -10.07 | 1 | 5 | 0 | 55 | 404.526 | 13 | ↓ |