| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 34 | Yes |
Popular Name: (S)-[4-[4-[4-[(S)-amino(phenyl)methyl]phenoxy]butoxy]phenyl]-phenyl-methanamine (S)-[4-[4-[4-[(S)-amino(phenyl)m…
| 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) | 6.14 | 12.41 | -101.07 | 6 | 4 | 2 | 74 | 454.614 | 11 | ↓ |
| Hi High (pH 8-9.5) | 6.14 | 12.08 | -51.55 | 5 | 4 | 1 | 72 | 453.606 | 11 | ↓ |
| Hi High (pH 8-9.5) | 6.14 | 11.75 | -8.41 | 4 | 4 | 0 | 71 | 452.598 | 11 | ↓ |
