In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 21 | Yes |
Popular Name: 7-[[cyclopropylmethyl(propyl)amino]methyl]-2-ethyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one 7-[[cyclopropylmethyl(propyl)ami…
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) | 2.53 | 9.59 | -45.63 | 1 | 5 | 1 | 52 | 307.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 6.6 | -13.47 | 0 | 5 | 0 | 51 | 306.435 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.