In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2010 | 28 | Yes |
Popular Name: 4-methyl-N-(3-oxo-3-piperazin-1-yl-propyl)-N-(3-pyrrolidin-1-ylpropyl)benzamide 4-methyl-N-(3-oxo-3-piperazin-1-…
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) | 0.97 | 8.72 | -52.62 | 2 | 6 | 1 | 57 | 387.548 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 10.01 | -105.78 | 3 | 6 | 2 | 62 | 388.556 | 8 | ↓ |