In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 21 | Yes |
Popular Name: 2-isopropyl-4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)imidazole-1,5-diamine 2-isopropyl-4-(1-methyl-3,4-dihy…
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) | 2.39 | 7.49 | -24.88 | 5 | 5 | 1 | 74 | 286.403 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 6.97 | -9.72 | 4 | 5 | 0 | 73 | 285.395 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.39 | 8.12 | -73.61 | 6 | 5 | 2 | 76 | 287.411 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.