In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2010 | 16 | Yes |
Popular Name: 3-(Piperidin-4-yl)indolin-2-one 3-(Piperidin-4-yl)indolin-2-one
Find On: PubMed — Wikipedia — Google
CAS Numbers: 16223-25-9 , 72831-89-1 , 79098-85-4 , [72831-89-1] , [79098-85-4]
3-(piperidin-4-yl)-2,3-dihydro-1H-indol-2-one
3-(piperidin-4-yl)-2,3-dihydro-1H-indol-2-one hydrochloride
3-(Piperidin-4-yl)indolin-2-one hydrochloride
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) | 1.11 | 4.1 | -43.71 | 3 | 3 | 1 | 46 | 217.292 | 1 | ↓ |
Ref Reference (pH 7) | 1.11 | 4.1 | -43.75 | 3 | 3 | 1 | 46 | 217.292 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.80 | 3.33 | -47.25 | 3 | 3 | 0 | 55 | 216.284 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 304 - 306 | Enamine Building Blocks |
MP | 304...306 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
PUBCHEM_PATENT_ID | US4410528 | IBM Patent Data |