In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 16 | Yes |
Popular Name: (3R)-N3-[(3-fluorophenyl)methyl]-N3-methyl-pentane-1,3-diamine (3R)-N3-[(3-fluorophenyl)methyl]…
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) | 1.82 | 4.1 | -47.61 | 3 | 2 | 1 | 31 | 225.331 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.82 | 5.72 | -35.77 | 3 | 2 | 1 | 30 | 225.331 | 6 | ↓ |