In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 27 | Yes |
Popular Name: N,N-bis(4-fluorophenyl)-4-[(3S)-3-methylpiperazin-1-yl]butanamide N,N-bis(4-fluorophenyl)-4-[(3S)-…
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) | 3.93 | 9.35 | -41.28 | 2 | 4 | 1 | 40 | 374.455 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.93 | 8.07 | -7.82 | 1 | 4 | 0 | 36 | 373.447 | 6 | ↓ |