In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2008 | 16 | Yes |
Popular Name: 4-(Hexahydro-pyrrolo[1,2-a]pyrazin-2-yl)-phenylamine 4-(Hexahydro-pyrrolo[1,2-a]pyraz…
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CAS Number: 937607-36-8
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) | 1.40 | 5.66 | -33.44 | 3 | 3 | 1 | 34 | 218.324 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 3.53 | -3.5 | 2 | 3 | 0 | 32 | 217.316 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 5.52 | -83.67 | 4 | 3 | 2 | 35 | 219.332 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 6.35 | -102.85 | 4 | 3 | 2 | 35 | 219.332 | 1 | ↓ |