In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 32 | Yes |
Popular Name: N-propyl-N-[2-[4-(propylBLAHyl)piperazin-1-yl]ethyl]propan-1-amine N-propyl-N-[2-[4-(propylBLAHyl)p…
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) | 6.05 | 14.43 | -40.78 | 1 | 5 | 1 | 37 | 458.74 | 10 | ↓ |
Hi High (pH 8-9.5) | 6.05 | 12.33 | -5.44 | 0 | 5 | 0 | 35 | 457.732 | 10 | ↓ |
Lo Low (pH 4.5-6) | 6.05 | 16.65 | -129.22 | 2 | 5 | 2 | 38 | 459.748 | 10 | ↓ |