In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 15 | No |
Popular Name: N-(cyclopropylmethyl)-2-[(2S,6S)-2,6-dimethylthiomorpholin-4-yl]ethanamine N-(cyclopropylmethyl)-2-[(2S,6S)…
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) | 1.76 | 6.46 | -43.17 | 2 | 2 | 1 | 20 | 229.413 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 8.16 | -121.86 | 3 | 2 | 2 | 21 | 230.421 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.