In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 25 | Yes |
Popular Name: (1-{[4-(Isopropoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]carbonyl}piperidin-4-yl)acetic acid (1-{[4-(Isopropoxycarbonyl)-3,5-…
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CAS Numbers: , 1142210-05-6 , [1142210-05-6]
(1-{[4-(isopropoxycarbonyl)-3,5-dimethyl-1h-pyrrol-2-yl]carbonyl}piperidin-4-yl)aceticacid
4-piperidineacetic acid, 1-[[3,5-dimethyl-4-[(1-methylethoxy)carbonyl]-1H-pyrrol-2-yl]carbonyl]-
ISOPROPOXYCARBONYLDIMETHYLPYRROLYLCARBONYLPIPERIDINYLACETICACI
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) | 2.10 | 8.93 | -50.53 | 1 | 7 | -1 | 103 | 349.407 | 6 | ↓ |
Note Type | Comments | Provided By |
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Warnings | IRRITANT | Matrix Scientific |