In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: (2S)-2-[[(1S)-1-(2,5-dimethyl-3-furyl)ethyl]amino]-N,N-diethyl-propanamide (2S)-2-[[(1S)-1-(2,5-dimethyl-3-…
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 | 7.26 | -37.74 | 2 | 4 | 1 | 50 | 267.393 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 6.25 | -10.02 | 1 | 4 | 0 | 45 | 266.385 | 6 | ↓ |