In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: 2-[4-[(2R)-2-amino-3-methyl-butanoyl]piperazin-1-yl]-N,N-dimethyl-acetamide 2-[4-[(2R)-2-amino-3-methyl-buta…
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) | -1.55 | 0.96 | -50.06 | 3 | 6 | 1 | 71 | 271.385 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.55 | 0.65 | -14.57 | 2 | 6 | 0 | 70 | 270.377 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.55 | 3.05 | -108.4 | 4 | 6 | 2 | 73 | 272.393 | 4 | ↓ |