In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 17 | Yes |
Popular Name: N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]cyclopentanamine N-[(1R)-1-[4-(2-methoxyethyl)-1,…
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) | 1.07 | 6.53 | -38.94 | 2 | 5 | 1 | 57 | 239.343 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 5.5 | -8.78 | 1 | 5 | 0 | 52 | 238.335 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.