In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 12th, 2010 | 22 | Yes |
Popular Name: (5R)-5-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]piperidin-2-one (5R)-5-[4-[(5-chloro-2-thienyl)m…
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) | 1.53 | 3.83 | -11.93 | 1 | 5 | 0 | 53 | 341.864 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.53 | 6.04 | -57.21 | 2 | 5 | 1 | 54 | 342.872 | 3 | ↓ |