In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 18 | Yes |
Popular Name: 3-[5-[[(2R)-2-(aminomethyl)morpholin-4-yl]methyl]-3-thienyl]prop-2-yn-1-ol 3-[5-[[(2R)-2-(aminomethyl)morph…
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) | -0.23 | -0.26 | -47.61 | 4 | 4 | 1 | 60 | 267.374 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.23 | -0.71 | -9 | 3 | 4 | 0 | 59 | 266.366 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.