In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 20 | Yes |
Popular Name: (2R)-2-[methyl-[(3S)-1,2,3,4-tetrahydroisoquinoline-3-carbonyl]amino]butanoic (2R)-2-[methyl-[(3S)-1,2,3,4-tet…
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) | -0.52 | 5.86 | -48.33 | 1 | 5 | -1 | 72 | 275.328 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.52 | 7.12 | -57.58 | 2 | 5 | 0 | 77 | 276.336 | 4 | ↓ |