In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 19 | Yes |
Popular Name: N-[(S)-(4-bromo-2-thienyl)-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)methyl]propan-1-amine N-[(S)-(4-bromo-2-thienyl)-(5,6-…
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) | 4.42 | 7.28 | -5.37 | 1 | 2 | 0 | 25 | 357.342 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 8.46 | -35.28 | 2 | 2 | 1 | 29 | 358.35 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.