In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 19 | No |
Popular Name: 2-[cyclobutylmethyl(methyl)amino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide 2-[cyclobutylmethyl(methyl)amino…
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) | 2.81 | 8.98 | -32.09 | 3 | 3 | 1 | 43 | 276.429 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.81 | 8.54 | -10.75 | 2 | 3 | 0 | 42 | 275.421 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.