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) | 6.82 | 13.18 | -49.1 | 2 | 7 | 1 | 90 | 508.513 | 12 | ↓ |
Hi High (pH 8-9.5) | 6.82 | 13.95 | -29.79 | 1 | 7 | 0 | 93 | 507.505 | 12 | ↓ |
Hi High (pH 8-9.5) | 6.82 | 10.83 | -9.2 | 1 | 7 | 0 | 89 | 507.505 | 12 | ↓ |