In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | No |
Popular Name: (2S)-2-amino-N-(6-nitro-1,3-benzodioxol-5-yl)propanamide (2S)-2-amino-N-(6-nitro-1,3-benz…
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) | 0.10 | 1.25 | -49.21 | 4 | 8 | 1 | 121 | 254.222 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.10 | 0.91 | -8.13 | 3 | 8 | 0 | 119 | 253.214 | 3 | ↓ |