In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (3R)-3-amino-N,N-bis(2-cyanoethyl)-3-phenyl-propanamide (3R)-3-amino-N,N-bis(2-cyanoethy…
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) | -2.04 | 6.58 | -59.83 | 3 | 5 | 1 | 96 | 271.344 | 7 | ↓ |
Hi High (pH 8-9.5) | -2.04 | 6.22 | -17.58 | 2 | 5 | 0 | 94 | 270.336 | 7 | ↓ |