In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 20 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)thiophene-2-carboxamide 5-(3-aminoprop-1-ynyl)-N-(5,6-di…
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) | 1.99 | 5.36 | -13.91 | 3 | 4 | 0 | 68 | 303.412 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.99 | 5.77 | -62.43 | 4 | 4 | 1 | 70 | 304.42 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.