In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 16 | Yes |
Popular Name: 7-chloro-2-[(ethylamino)methyl]quinazolin-4(3H)-one hydrochloride 7-chloro-2-[(ethylamino)methyl]q…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1052537-78-6 , 900640-73-5
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) | 1.68 | 3.09 | -7.25 | 2 | 4 | 0 | 58 | 237.69 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 1.88 | -42.09 | 2 | 4 | 0 | 65 | 237.69 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 4.45 | -49.84 | 3 | 4 | 1 | 62 | 238.698 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 178 - 180 | Enamine Building Blocks |
MP | 178...180 | Enamine Building Blocks |
MP | 253 - 255 | Enamine Building Blocks |
MP | 253...255 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |