In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2011 | 21 | Yes |
Popular Name: (S)-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-(1-propylpyrazol-4-yl)methanol (S)-(1-methyl-3,4-dihydro-2H-qui…
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) | 2.70 | 6.86 | -8.91 | 1 | 4 | 0 | 41 | 285.391 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.70 | 7.5 | -37.3 | 2 | 4 | 1 | 42 | 286.399 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.