In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 21 | No |
Popular Name: (2-chloro-5-nitro-phenyl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (2-chloro-5-nitro-phenyl)-[4-(2-…
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) | 0.73 | 2.57 | -9.91 | 1 | 7 | 0 | 90 | 313.741 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.73 | 4.91 | -43.35 | 2 | 7 | 1 | 91 | 314.749 | 4 | ↓ |