In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: 1-[4-(5-aminopentyl)piperazin-1-yl]-2-ethyl-butan-1-one 1-[4-(5-aminopentyl)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) | 1.53 | 3.95 | -47.36 | 3 | 4 | 1 | 51 | 270.441 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 6.15 | -102.88 | 4 | 4 | 2 | 52 | 271.449 | 8 | ↓ |