In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 17 | Yes |
Popular Name: (2R)-2-methyl-3-(4-pentanoylpiperazin-1-yl)propanenitrile (2R)-2-methyl-3-(4-pentanoylpipe…
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) | 2.03 | 5.84 | -11.73 | 0 | 4 | 0 | 47 | 237.347 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.03 | 7.79 | -58.18 | 1 | 4 | 1 | 49 | 238.355 | 5 | ↓ |