In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: 1-(3-methylbut-2-enyl)-N-[(1R)-1-[(2S)-tetrahydrofuran-2-yl]ethyl]piperidin-4-amine 1-(3-methylbut-2-enyl)-N-[(1R)-1…
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) | 2.90 | 6.9 | -32.5 | 2 | 3 | 1 | 26 | 267.437 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 5.69 | -33.04 | 2 | 3 | 1 | 29 | 267.437 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | 7.95 | -99.78 | 3 | 3 | 2 | 30 | 268.445 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.