In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 25 | Yes |
Popular Name: (2S)-N-[2-(1H-indol-3-yl)ethyl]-2-[methyl-[(3-methyl-2-thienyl)methyl]amino]propanamide (2S)-N-[2-(1H-indol-3-yl)ethyl]-…
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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) | 3.41 | 9.6 | -41.87 | 3 | 4 | 1 | 49 | 356.515 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.41 | 7.27 | -11.88 | 2 | 4 | 0 | 48 | 355.507 | 7 | ↓ |