In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2011 | 21 | Yes |
Popular Name: N-[[4-cyclopropyl-2-(1,4-oxazepan-4-yl)thiazol-5-yl]methyl]-2-methyl-propan-2-amine N-[[4-cyclopropyl-2-(1,4-oxazepa…
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) | 2.78 | 8.49 | -36.83 | 2 | 4 | 1 | 42 | 310.487 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.78 | 7.27 | -4.95 | 1 | 4 | 0 | 37 | 309.479 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.