In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 18 | Yes |
Popular Name: (3S)-3-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1,2,3,4-tetrahydroisoquinoline (3S)-3-(3-isopropyl-1,2,4-oxadia…
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) | 2.21 | 3.53 | -5.62 | 1 | 4 | 0 | 51 | 243.31 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.21 | 4.88 | -46.28 | 2 | 4 | 1 | 56 | 244.318 | 2 | ↓ |