In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2011 | 21 | Yes |
Popular Name: (3-amino-4-bromo-phenyl)-[4-(2-dimethylaminoethyl)piperazin-1-yl]methanone (3-amino-4-bromo-phenyl)-[4-(2-d…
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) | 1.05 | 4.58 | -43.19 | 3 | 5 | 1 | 54 | 356.288 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.05 | 2.1 | -7.33 | 2 | 5 | 0 | 53 | 355.28 | 4 | ↓ |