In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | No |
Popular Name: (2S)-2-bromo-1-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-3-methyl-butan-1-one (2S)-2-bromo-1-[4-[(5-chloro-2-t…
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) | 3.50 | 7.1 | -8.52 | 0 | 3 | 0 | 24 | 379.751 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.50 | 9.32 | -52.15 | 1 | 3 | 1 | 25 | 380.759 | 4 | ↓ |