In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2011 | 18 | Yes |
Popular Name: (2S,3S)-2-amino-N-[(2,3-dichlorophenyl)methyl]-3-methyl-pentanamide (2S,3S)-2-amino-N-[(2,3-dichloro…
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) | 2.56 | 5.03 | -44.34 | 4 | 3 | 1 | 57 | 290.214 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 4.71 | -7.6 | 3 | 3 | 0 | 55 | 289.206 | 5 | ↓ |