In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 24 | Yes |
Popular Name: 2-[isobutyl-[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]amino]acetamide 2-[isobutyl-[(1-phenyl-5,6-dihyd…
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) | 2.21 | 8.34 | -35.4 | 3 | 5 | 1 | 65 | 327.452 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 6.17 | -15.2 | 2 | 5 | 0 | 64 | 326.444 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.