In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2010 | 28 | Yes |
Popular Name: 4-bromo-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-N-(3-oxo-3-piperazin-1-yl-propyl)benzamide 4-bromo-N-[[(2R)-1-ethylpyrrolid…
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) | 1.43 | 8.42 | -40.76 | 2 | 6 | 1 | 57 | 452.417 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 9.72 | -93.3 | 3 | 6 | 2 | 62 | 453.425 | 7 | ↓ |