In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 17 | Yes |
Popular Name: 1-[4-(2-aminoacetyl)piperazin-1-yl]-2-ethyl-butan-1-one 1-[4-(2-aminoacetyl)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) | -0.19 | 2.58 | -59.06 | 3 | 5 | 1 | 68 | 242.343 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.19 | 2.2 | -15.4 | 2 | 5 | 0 | 67 | 241.335 | 4 | ↓ |