In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 17 | Yes |
Popular Name: 2-[[(1R)-1-cyclohexylethyl]amino]-1-pyrrolidin-1-yl-ethanone 2-[[(1R)-1-cyclohexylethyl]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) | 2.47 | 6.79 | -39.41 | 2 | 3 | 1 | 37 | 239.383 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 5.69 | -7.28 | 1 | 3 | 0 | 32 | 238.375 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.