In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 18 | Yes |
Popular Name: (3R)-N1-[(2-fluorophenyl)methyl]-N1-methyl-N3-propyl-butane-1,3-diamine (3R)-N1-[(2-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) | 3.12 | 6.79 | -38.14 | 2 | 2 | 1 | 20 | 253.385 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.12 | 7.93 | -35.19 | 2 | 2 | 1 | 16 | 253.385 | 8 | ↓ |