| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 20 | Yes |
Popular Name: (3S)-3-[methyl-[[(2S)-tetrahydropyran-2-yl]methyl]amino]-3-phenyl-propanamidine (3S)-3-[methyl-[[(2S)-tetrahydro…
| 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) | 2.16 | 4.04 | -33.81 | 4 | 4 | 1 | 64 | 276.404 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 6.7 | -101.56 | 5 | 4 | 2 | 65 | 277.412 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
