In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2008 | 30 | Yes |
Popular Name: 1-benzyl-4-{[1-(4-bromobenzoyl)-4-piperidinyl]carbonyl}piperazine 1-benzyl-4-{[1-(4-bromobenzoyl)-…
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) | 3.13 | 10.19 | -15.87 | 0 | 5 | 0 | 44 | 470.411 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 12.4 | -57.91 | 1 | 5 | 1 | 45 | 471.419 | 4 | ↓ |