In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 21 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)pyridine-3-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) | 0.60 | 4.82 | -59.08 | 4 | 5 | 1 | 83 | 299.379 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 3.81 | -11 | 3 | 5 | 0 | 84 | 298.371 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.