In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 17 | Yes |
Popular Name: (4-chloro-2-hydroxy-phenyl)-(4-methylpiperazin-1-yl)methanone (4-chloro-2-hydroxy-phenyl)-(4-m…
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) | 1.94 | 2.37 | -11.92 | 1 | 4 | 0 | 44 | 254.717 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 4.78 | -48.81 | 2 | 4 | 1 | 45 | 255.725 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 5.72 | -70.35 | 1 | 4 | 0 | 48 | 254.717 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 3.31 | -50.8 | 0 | 4 | -1 | 47 | 253.709 | 1 | ↓ |