In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2009 | 17 | Yes |
Popular Name: (2S)-2-amino-N-[(3-chlorophenyl)methyl]butanediamide (2S)-2-amino-N-[(3-chlorophenyl)…
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) | 0.56 | -0.89 | -41.16 | 6 | 5 | 1 | 100 | 256.713 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.56 | -1.23 | -11.62 | 5 | 5 | 0 | 98 | 255.705 | 5 | ↓ |