In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 16 | Yes |
Popular Name: 1-Pyrrolidin-1-ylmethyl-decahydro-isoquinoline 1-Pyrrolidin-1-ylmethyl-decahydr…
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CAS Number: 131847-40-0
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) | 2.80 | 7.83 | -114.88 | 3 | 2 | 2 | 21 | 224.392 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 7.75 | -31.46 | 2 | 2 | 1 | 16 | 223.384 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 7.51 | -37.55 | 2 | 2 | 1 | 20 | 223.384 | 2 | ↓ |