In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 17 | Yes |
Popular Name: N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethyl)-1-pyrimidin-4-yl-methanamine N-(5,6-dihydro-4H-cyclopenta[b]t…
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) | 1.76 | 6.02 | -7.4 | 1 | 3 | 0 | 38 | 245.351 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 7.39 | -45.46 | 2 | 3 | 1 | 42 | 246.359 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.