In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2008 | 23 | Yes |
Popular Name: 4-[[[(3R)-1,2,3,4-tetrahydroisoquinoline-3-carbonyl]amino]methyl]cyclohexane-1-carboxylic 4-[[[(3R)-1,2,3,4-tetrahydroisoq…
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) | 1.51 | 6.38 | -49.75 | 2 | 5 | -1 | 81 | 315.393 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.51 | 7.77 | -74.63 | 3 | 5 | 0 | 86 | 316.401 | 4 | ↓ |