In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: (3S)-N-isobutyl-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide (3S)-N-isobutyl-N-methyl-1,2,3,4…
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) | 1.95 | 5.7 | -7.7 | 1 | 3 | 0 | 32 | 246.354 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.95 | 7 | -38.1 | 2 | 3 | 1 | 37 | 247.362 | 3 | ↓ |