In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 23 | Yes |
Popular Name: (3S)-N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-4,4,4-trifluoro-3-phenyl-butanamide (3S)-N-[(3R)-1-cyclopropylpyrrol…
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) | 3.20 | 9.02 | -39.78 | 2 | 3 | 1 | 34 | 327.37 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.20 | 6.58 | -6.24 | 1 | 3 | 0 | 32 | 326.362 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.