In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 20 | Yes |
Popular Name: (3S)-2-[(5-bromo-2-thienyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide (3S)-2-[(5-bromo-2-thienyl)methy…
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) | 3.24 | 4.67 | -9.85 | 2 | 3 | 0 | 46 | 351.269 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.