In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (2R)-2-amino-N-[(4-dimethylaminophenyl)methyl]-N-methyl-butanamide (2R)-2-amino-N-[(4-dimethylamino…
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) | 0.91 | 4.78 | -41.74 | 3 | 4 | 1 | 51 | 250.366 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.91 | 4.47 | -8.01 | 2 | 4 | 0 | 50 | 249.358 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | 5.55 | -66.66 | 4 | 4 | 0 | 52 | 251.374 | 5 | ↓ |