| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 21 | Yes |
Popular Name: (3S)-3-amino-3-phenyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]propanamide (3S)-3-amino-3-phenyl-N-[(4R)-4,…
| 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) | -0.11 | 6.53 | -40.44 | 4 | 3 | 1 | 57 | 301.435 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.11 | 6.17 | -8.57 | 3 | 3 | 0 | 55 | 300.427 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
