In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 21 | Yes |
Popular Name: N-(3-amino-4-chloro-phenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide N-(3-amino-4-chloro-phenyl)-2-[4…
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) | 0.86 | 0.32 | -37.53 | 5 | 6 | 1 | 83 | 313.809 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.86 | -1.97 | -15.18 | 4 | 6 | 0 | 82 | 312.801 | 5 | ↓ |
Popular Name: N-(3-amino-4-chloro-phenyl)-2-[2-hydroxyethyl(isopropyl)amino]acetamide N-(3-amino-4-chloro-phenyl)-2-[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) | 1.64 | 1.62 | -39.13 | 5 | 5 | 1 | 80 | 286.783 | 6 | ↓ |