In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 21 | No |
Popular Name: (2S)-N,N,4-trimethyl-2-[(3-nitrophenyl)methylamino]pentanamide (2S)-N,N,4-trimethyl-2-[(3-nitro…
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) | 1.98 | 7.91 | -46.41 | 2 | 6 | 1 | 83 | 294.375 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 6.95 | -10.08 | 1 | 6 | 0 | 78 | 293.367 | 7 | ↓ |