In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 20 | Yes |
Popular Name: (4S)-4-[(3-methylisoxazolo[5,4-b]pyridine-5-carbonyl)amino]pentanoic (4S)-4-[(3-methylisoxazolo[5,4-b…
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) | 0.34 | 3.08 | -48.94 | 1 | 7 | -1 | 108 | 276.272 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.34 | 1.1 | -15.46 | 2 | 7 | 0 | 105 | 277.28 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.