In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (2R,3S)-2-amino-N,3-dimethyl-N-[(1S)-1-(5-methyl-2-thienyl)ethyl]pentanamide (2R,3S)-2-amino-N,3-dimethyl-N-[…
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) | 2.23 | 5.89 | -41.92 | 3 | 3 | 1 | 48 | 269.434 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 5.55 | -7.42 | 2 | 3 | 0 | 46 | 268.426 | 5 | ↓ |