In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: (2S)-2-amino-N-methyl-N-(4-methylcyclohexyl)butanediamide (2S)-2-amino-N-methyl-N-(4-methy…
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) | 0.43 | 0.53 | -38.25 | 5 | 5 | 1 | 91 | 242.343 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.43 | 0.19 | -11.08 | 4 | 5 | 0 | 89 | 241.335 | 4 | ↓ |