In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | No |
Popular Name: (2S)-2-bromo-N,3-dimethyl-N-[(1S)-1-(4-pyridyl)ethyl]butanamide (2S)-2-bromo-N,3-dimethyl-N-[(1S…
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) | 2.18 | 6.49 | -10.1 | 0 | 3 | 0 | 33 | 299.212 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.18 | 6.95 | -41.76 | 1 | 3 | 1 | 34 | 300.22 | 4 | ↓ |