In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2010 | 13 | Yes |
Popular Name: Pyrrolo[1,2-a]pyrazine-3-carboxylic acid, octahydro-, methyl ester, (3R-trans)- (9CI) Pyrrolo[1,2-a]pyrazine-3-carboxy…
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CAS Number: 181795-67-5
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) | 0.23 | 2.81 | -30.88 | 2 | 4 | 1 | 43 | 185.247 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.23 | 0.7 | -4.79 | 1 | 4 | 0 | 42 | 184.239 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | 4.06 | -109.57 | 3 | 4 | 2 | 47 | 186.255 | 2 | ↓ |