In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 19 | Yes |
Popular Name: [(2R,3S)-4-propyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholin-2-yl]methanamine [(2R,3S)-4-propyl-3-(1,3,5-trime…
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) | 0.26 | 2.99 | -42.96 | 3 | 5 | 1 | 58 | 267.397 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.26 | 2.63 | -6.16 | 2 | 5 | 0 | 56 | 266.389 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.26 | 3.67 | -104.91 | 4 | 5 | 2 | 59 | 268.405 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.