In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: (2S,3S)-2-amino-N-butyl-3-methyl-N-[(1S)-1-methylpropyl]pentanamide (2S,3S)-2-amino-N-butyl-3-methyl…
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) | 2.80 | 6.3 | -41.65 | 3 | 3 | 1 | 48 | 243.415 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 6.01 | -5.47 | 2 | 3 | 0 | 46 | 242.407 | 8 | ↓ |