In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 34 | Yes |
Popular Name: 1-[(1S)-2-(4-benzhydrylpiperazino)-2-keto-1-methyl-ethyl]-3-(2-fluorophenyl)urea 1-[(1S)-2-(4-benzhydrylpiperazin…
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) | 4.31 | 10.41 | -9.41 | 2 | 6 | 0 | 65 | 460.553 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.31 | 12.2 | -45.72 | 3 | 6 | 1 | 66 | 461.561 | 6 | ↓ |