In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 27 | No |
Popular Name: 3-[[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]thiazolidin-2-one 3-[[(1S)-6,7-dimethoxy-1-phenyl-…
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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) | 3.40 | 8.37 | -16.15 | 0 | 5 | 0 | 42 | 384.501 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.40 | 10.54 | -51.19 | 1 | 5 | 1 | 43 | 385.509 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.