In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2011 | 18 | Yes |
Popular Name: (2R)-2-(cyclopropylamino)-4-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]butanamide (2R)-2-(cyclopropylamino)-4-[met…
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) | 0.42 | 1.8 | -45.42 | 4 | 5 | 1 | 69 | 256.37 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.42 | -0.54 | -9.22 | 3 | 5 | 0 | 68 | 255.362 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.42 | 2.78 | -109.15 | 5 | 5 | 2 | 73 | 257.378 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.