In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 21 | Yes |
Popular Name: 1-[(2-tert-butylthiazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-6-amine 1-[(2-tert-butylthiazol-4-yl)met…
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) | 3.61 | 7.82 | -6.64 | 2 | 3 | 0 | 42 | 301.459 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.61 | 8.06 | -27.54 | 3 | 3 | 1 | 43 | 302.467 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.