| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 19 | Yes |
Popular Name: (2S)-N-allyl-2-amino-N-[(5-chloro-2-thienyl)methyl]butanediamide (2S)-N-allyl-2-amino-N-[(5-chlor…
| 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) | 1.50 | 1.76 | -38.27 | 5 | 5 | 1 | 91 | 302.807 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 1.41 | -9.46 | 4 | 5 | 0 | 89 | 301.799 | 7 | ↓ |
