In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 19 | Yes |
Popular Name: [1-(aminomethyl)cyclopentyl]-(4-isobutylpiperazin-1-yl)methanone [1-(aminomethyl)cyclopentyl]-(4-…
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) | 0.96 | 5.71 | -104.9 | 4 | 4 | 2 | 52 | 269.433 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 3.77 | -47.63 | 3 | 4 | 1 | 51 | 268.425 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.