In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 36 | Yes |
Popular Name: propyl propyl
None
None
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) | 3.46 | 13.59 | -48.89 | 2 | 8 | 1 | 103 | 493.58 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 14.34 | -38.87 | 1 | 8 | 0 | 106 | 492.572 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 11.47 | -20.74 | 1 | 8 | 0 | 102 | 492.572 | 8 | ↓ |