In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 24 | Yes |
Popular Name: 3-[2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)ethylamino]-N-thiazol-2-yl-propanamide 3-[2-(4-methyl-5,6,7,8-tetrahydr…
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) | 1.47 | 6.72 | -54.49 | 3 | 6 | 1 | 84 | 346.48 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 5.38 | -18.35 | 2 | 6 | 0 | 80 | 345.472 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.