In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 20 | No |
Popular Name: (2S)-2-bromo-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]butanamide (2S)-2-bromo-N-[(2S)-2-morpholin…
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) | 2.38 | 3.67 | -8.21 | 1 | 4 | 0 | 42 | 361.305 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.38 | 6.01 | -38.91 | 2 | 4 | 1 | 43 | 362.313 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.