In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 21 | Yes |
Popular Name: (3-chloro-4-ethoxy-5-methoxy-phenyl)-(4-methylpiperazin-1-yl)methanone (3-chloro-4-ethoxy-5-methoxy-phe…
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) | 1.62 | 7.02 | -45.67 | 1 | 5 | 1 | 43 | 313.805 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 4.67 | -7.32 | 0 | 5 | 0 | 42 | 312.797 | 4 | ↓ |