In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 21 | Yes |
Popular Name: (2S)-2-[(5-bromo-2-methoxy-phenyl)methylamino]-N,N,4-trimethyl-pentanamide (2S)-2-[(5-bromo-2-methoxy-pheny…
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) | 2.84 | 7.21 | -39.24 | 2 | 4 | 1 | 46 | 358.3 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 7.34 | -8.07 | 1 | 4 | 0 | 42 | 357.292 | 7 | ↓ |