In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 8th, 2011 | 25 | Yes |
Popular Name: (2S)-2-(4-ethyl-N-methylsulfonyl-anilino)-N-(4-pyridylmethyl)propanamide (2S)-2-(4-ethyl-N-methylsulfonyl…
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) | 1.88 | 4.89 | -19.33 | 1 | 6 | 0 | 79 | 361.467 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.88 | 5.34 | -50.28 | 2 | 6 | 1 | 81 | 362.475 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.